GEEP coefficients for fixed radii. THIS IS THE GEEP LIB. They can be used together with the "omotetia" rule for erf function to obtain the expansion for whatever radius one desires Radius value are in Angstrom. More...

Variables
integer, parameter, public	min_geep_lib_gauss = 2

integer, parameter, public	max_geep_lib_gauss = 18

real(kind=dp), parameter, public	g2_rc = 1.30_dp

real(kind=dp), parameter, public	g2_a1 = 0.121492_dp

real(kind=dp), parameter, public	g2_b1 = 3.85695_dp

real(kind=dp), parameter, public	g2_a2 = 0.104509_dp

real(kind=dp), parameter, public	g2_b2 = 2.72971_dp

real(kind=dp), parameter, public	g3_rc = 1.17_dp

real(kind=dp), parameter, public	g3_a1 = 0.1142400_dp

real(kind=dp), parameter, public	g3_b1 = 3.08635_dp

real(kind=dp), parameter, public	g3_a2 = 0.0867876_dp

real(kind=dp), parameter, public	g3_b2 = 2.38345_dp

real(kind=dp), parameter, public	g3_a3 = 0.0971514_dp

real(kind=dp), parameter, public	g3_b3 = 4.35065_dp

real(kind=dp), parameter, public	g4_rc = 1.05_dp

real(kind=dp), parameter, public	g4_a1 = 0.0776927_dp

real(kind=dp), parameter, public	g4_b1 = 2.10429_dp

real(kind=dp), parameter, public	g4_a2 = 0.1123350_dp

real(kind=dp), parameter, public	g4_b2 = 2.59523_dp

real(kind=dp), parameter, public	g4_a3 = 0.0812506_dp

real(kind=dp), parameter, public	g4_b3 = 4.73860_dp

real(kind=dp), parameter, public	g4_a4 = 0.0989222_dp

real(kind=dp), parameter, public	g4_b4 = 3.44579_dp

real(kind=dp), parameter, public	g5_rc = 0.9_dp

real(kind=dp), parameter, public	g5_a1 = 0.0728205_dp

real(kind=dp), parameter, public	g5_b1 = 4.98419_dp

real(kind=dp), parameter, public	g5_a2 = 0.0797713_dp

real(kind=dp), parameter, public	g5_b2 = 1.78985_dp

real(kind=dp), parameter, public	g5_a3 = 0.0885763_dp

real(kind=dp), parameter, public	g5_b3 = 3.68614_dp

real(kind=dp), parameter, public	g5_a4 = 0.1104310_dp

real(kind=dp), parameter, public	g5_b4 = 2.78214_dp

real(kind=dp), parameter, public	g5_a5 = 0.1211280_dp

real(kind=dp), parameter, public	g5_b5 = 2.15508_dp

real(kind=dp), parameter, public	g6_rc = 0.9_dp

real(kind=dp), parameter, public	g6_a1 = 0.0863850_dp

real(kind=dp), parameter, public	g6_b1 = 3.20872_dp

real(kind=dp), parameter, public	g6_a2 = 0.0704031_dp

real(kind=dp), parameter, public	g6_b2 = 4.12508_dp

real(kind=dp), parameter, public	g6_a3 = 0.0604464_dp

real(kind=dp), parameter, public	g6_b3 = 5.40108_dp

real(kind=dp), parameter, public	g6_a4 = 0.1029610_dp

real(kind=dp), parameter, public	g6_b4 = 2.04751_dp

real(kind=dp), parameter, public	g6_a5 = 0.1020950_dp

real(kind=dp), parameter, public	g6_b5 = 2.52820_dp

real(kind=dp), parameter, public	g6_a6 = 0.0621064_dp

real(kind=dp), parameter, public	g6_b6 = 1.76831_dp

real(kind=dp), parameter, public	g7_rc = 0.85_dp

real(kind=dp), parameter, public	g7_a1 = 0.0969005_dp

real(kind=dp), parameter, public	g7_b1 = 1.88076_dp

real(kind=dp), parameter, public	g7_a2 = 0.0556821_dp

real(kind=dp), parameter, public	g7_b2 = 1.65955_dp

real(kind=dp), parameter, public	g7_a3 = 0.0607934_dp

real(kind=dp), parameter, public	g7_b3 = 4.42485_dp

real(kind=dp), parameter, public	g7_a4 = 0.0888440_dp

real(kind=dp), parameter, public	g7_b4 = 2.79941_dp

real(kind=dp), parameter, public	g7_a5 = 0.0535919_dp

real(kind=dp), parameter, public	g7_b5 = 5.68373_dp

real(kind=dp), parameter, public	g7_a6 = 0.0736222_dp

real(kind=dp), parameter, public	g7_b6 = 3.50534_dp

real(kind=dp), parameter, public	g7_a7 = 0.1011310_dp

real(kind=dp), parameter, public	g7_b7 = 2.26261_dp

real(kind=dp), parameter, public	g8_rc = 0.80_dp

real(kind=dp), parameter, public	g8_a1 = 0.0557370_dp

real(kind=dp), parameter, public	g8_b1 = 1.55883_dp

real(kind=dp), parameter, public	g8_a2 = 0.0450800_dp

real(kind=dp), parameter, public	g8_b2 = 6.02024_dp

real(kind=dp), parameter, public	g8_a3 = 0.0496262_dp

real(kind=dp), parameter, public	g8_b3 = 4.82212_dp

real(kind=dp), parameter, public	g8_a4 = 0.0757863_dp

real(kind=dp), parameter, public	g8_b4 = 3.16120_dp

real(kind=dp), parameter, public	g8_a5 = 0.0608617_dp

real(kind=dp), parameter, public	g8_b5 = 3.90652_dp

real(kind=dp), parameter, public	g8_a6 = 0.1040810_dp

real(kind=dp), parameter, public	g8_b6 = 2.09075_dp

real(kind=dp), parameter, public	g8_a7 = 0.0983610_dp

real(kind=dp), parameter, public	g8_b7 = 1.75423_dp

real(kind=dp), parameter, public	g8_a8 = 0.0920273_dp

real(kind=dp), parameter, public	g8_b8 = 2.55933_dp

real(kind=dp), parameter, public	g9_rc = 0.70_dp

real(kind=dp), parameter, public	g9_a1 = 0.1152140_dp

real(kind=dp), parameter, public	g9_b1 = 1.54224_dp

real(kind=dp), parameter, public	g9_a2 = 0.0280838_dp

real(kind=dp), parameter, public	g9_b2 = 5.91022_dp

real(kind=dp), parameter, public	g9_a3 = 0.0718097_dp

real(kind=dp), parameter, public	g9_b3 = 3.54224_dp

real(kind=dp), parameter, public	g9_a4 = 0.0585113_dp

real(kind=dp), parameter, public	g9_b4 = 4.44860_dp

real(kind=dp), parameter, public	g9_a5 = 0.1068470_dp

real(kind=dp), parameter, public	g9_b5 = 2.27491_dp

real(kind=dp), parameter, public	g9_a6 = 0.0883974_dp

real(kind=dp), parameter, public	g9_b6 = 2.83230_dp

real(kind=dp), parameter, public	g9_a7 = 0.1211100_dp

real(kind=dp), parameter, public	g9_b7 = 1.84735_dp

real(kind=dp), parameter, public	g9_a8 = 0.0273353_dp

real(kind=dp), parameter, public	g9_b8 = 5.52297_dp

real(kind=dp), parameter, public	g9_a9 = 0.0657478_dp

real(kind=dp), parameter, public	g9_b9 = 1.36539_dp

real(kind=dp), parameter, public	g10_rc = 0.60_dp

real(kind=dp), parameter, public	g10_a1 = 0.1005460_dp

real(kind=dp), parameter, public	g10_b1 = 2.49407_dp

real(kind=dp), parameter, public	g10_a2 = 0.1246370_dp

real(kind=dp), parameter, public	g10_b2 = 1.99718_dp

real(kind=dp), parameter, public	g10_a3 = 0.0492434_dp

real(kind=dp), parameter, public	g10_b3 = 4.70767_dp

real(kind=dp), parameter, public	g10_a4 = 0.0785904_dp

real(kind=dp), parameter, public	g10_b4 = 3.10735_dp

real(kind=dp), parameter, public	g10_a5 = 0.0242791_dp

real(kind=dp), parameter, public	g10_b5 = 5.81268_dp

real(kind=dp), parameter, public	g10_a6 = 0.0229056_dp

real(kind=dp), parameter, public	g10_b6 = 5.92886_dp

real(kind=dp), parameter, public	g10_a7 = 0.0606229_dp

real(kind=dp), parameter, public	g10_b7 = 3.83892_dp

real(kind=dp), parameter, public	g10_a8 = 0.1442920_dp

real(kind=dp), parameter, public	g10_b8 = 1.61113_dp

real(kind=dp), parameter, public	g10_a9 = 0.0814189_dp

real(kind=dp), parameter, public	g10_b9 = 1.17276_dp

real(kind=dp), parameter, public	g10_a10 = 0.1401800_dp

real(kind=dp), parameter, public	g10_b10 = 1.33402_dp

real(kind=dp), parameter, public	g11_rc = 0.50_dp

real(kind=dp), parameter, public	g11_a1 = 0.1041690_dp

real(kind=dp), parameter, public	g11_b1 = 0.979627_dp

real(kind=dp), parameter, public	g11_a2 = 0.0271666_dp

real(kind=dp), parameter, public	g11_b2 = 5.799740_dp

real(kind=dp), parameter, public	g11_a3 = 0.0200111_dp

real(kind=dp), parameter, public	g11_b3 = 5.799660_dp

real(kind=dp), parameter, public	g11_a4 = 0.0483906_dp

real(kind=dp), parameter, public	g11_b4 = 4.203330_dp

real(kind=dp), parameter, public	g11_a5 = 0.1777430_dp

real(kind=dp), parameter, public	g11_b5 = 1.370190_dp

real(kind=dp), parameter, public	g11_a6 = 0.0731972_dp

real(kind=dp), parameter, public	g11_b6 = 3.415900_dp

real(kind=dp), parameter, public	g11_a7 = 0.0950076_dp

real(kind=dp), parameter, public	g11_b7 = 2.724470_dp

real(kind=dp), parameter, public	g11_a8 = 0.0295802_dp

real(kind=dp), parameter, public	g11_b8 = 4.825220_dp

real(kind=dp), parameter, public	g11_a9 = 0.1212380_dp

real(kind=dp), parameter, public	g11_b9 = 2.162170_dp

real(kind=dp), parameter, public	g11_a10 = 0.1513510_dp

real(kind=dp), parameter, public	g11_b10 = 1.714860_dp

real(kind=dp), parameter, public	g11_a11 = 0.1760780_dp

real(kind=dp), parameter, public	g11_b11 = 1.123400_dp

real(kind=dp), parameter, public	g12_rc = 0.40_dp

real(kind=dp), parameter, public	g12_a1 = 0.1420750_dp

real(kind=dp), parameter, public	g12_b1 = 0.786470_dp

real(kind=dp), parameter, public	g12_a2 = 0.0880114_dp

real(kind=dp), parameter, public	g12_b2 = 2.942550_dp

real(kind=dp), parameter, public	g12_a3 = 0.0645509_dp

real(kind=dp), parameter, public	g12_b3 = 3.669640_dp

real(kind=dp), parameter, public	g12_a4 = 0.1505330_dp

real(kind=dp), parameter, public	g12_b4 = 1.826690_dp

real(kind=dp), parameter, public	g12_a5 = 0.0183100_dp

real(kind=dp), parameter, public	g12_b5 = 5.965520_dp

real(kind=dp), parameter, public	g12_a6 = 0.0182645_dp

real(kind=dp), parameter, public	g12_b6 = 5.965520_dp

real(kind=dp), parameter, public	g12_a7 = 0.1160340_dp

real(kind=dp), parameter, public	g12_b7 = 2.326450_dp

real(kind=dp), parameter, public	g12_a8 = 0.0449121_dp

real(kind=dp), parameter, public	g12_b8 = 4.458350_dp

real(kind=dp), parameter, public	g12_a9 = 0.0264801_dp

real(kind=dp), parameter, public	g12_b9 = 5.182710_dp

real(kind=dp), parameter, public	g12_a10 = 0.2338230_dp

real(kind=dp), parameter, public	g12_b10 = 0.912631_dp

real(kind=dp), parameter, public	g12_a11 = 0.2295300_dp

real(kind=dp), parameter, public	g12_b11 = 1.128850_dp

real(kind=dp), parameter, public	g12_a12 = 0.1911980_dp

real(kind=dp), parameter, public	g12_b12 = 1.431550_dp

real(kind=dp), parameter, public	g13_rc = 0.30_dp

real(kind=dp), parameter, public	g13_a1 = 0.2001960_dp

real(kind=dp), parameter, public	g13_b1 = 0.591285_dp

real(kind=dp), parameter, public	g13_a2 = 0.0884682_dp

real(kind=dp), parameter, public	g13_b2 = 2.958380_dp

real(kind=dp), parameter, public	g13_a3 = 0.1999450_dp

real(kind=dp), parameter, public	g13_b3 = 1.420640_dp

real(kind=dp), parameter, public	g13_a4 = 0.3235490_dp

real(kind=dp), parameter, public	g13_b4 = 0.691636_dp

real(kind=dp), parameter, public	g13_a5 = 0.0636926_dp

real(kind=dp), parameter, public	g13_b5 = 3.693610_dp

real(kind=dp), parameter, public	g13_a6 = 0.0409795_dp

real(kind=dp), parameter, public	g13_b6 = 4.450810_dp

real(kind=dp), parameter, public	g13_a7 = 0.1172330_dp

real(kind=dp), parameter, public	g13_b7 = 2.332480_dp

real(kind=dp), parameter, public	g13_a8 = 0.0278787_dp

real(kind=dp), parameter, public	g13_b8 = 5.119550_dp

real(kind=dp), parameter, public	g13_a9 = 0.0187190_dp

real(kind=dp), parameter, public	g13_b9 = 5.952110_dp

real(kind=dp), parameter, public	g13_a10 = 0.0187159_dp

real(kind=dp), parameter, public	g13_b10 = 5.952110_dp

real(kind=dp), parameter, public	g13_a11 = 0.3118340_dp

real(kind=dp), parameter, public	g13_b11 = 0.863435_dp

real(kind=dp), parameter, public	g13_a12 = 0.2562320_dp

real(kind=dp), parameter, public	g13_b12 = 1.104410_dp

real(kind=dp), parameter, public	g13_a13 = 0.1535690_dp

real(kind=dp), parameter, public	g13_b13 = 1.824620_dp

real(kind=dp), parameter, public	g14_rc = 0.20_dp

real(kind=dp), parameter, public	g14_a1 = 0.3778350_dp

real(kind=dp), parameter, public	g14_b1 = 0.786779_dp

real(kind=dp), parameter, public	g14_a2 = 0.0944711_dp

real(kind=dp), parameter, public	g14_b2 = 2.781090_dp

real(kind=dp), parameter, public	g14_a3 = 0.0204159_dp

real(kind=dp), parameter, public	g14_b3 = 5.876050_dp

real(kind=dp), parameter, public	g14_a4 = 0.0204239_dp

real(kind=dp), parameter, public	g14_b4 = 5.876050_dp

real(kind=dp), parameter, public	g14_a5 = 0.2884320_dp

real(kind=dp), parameter, public	g14_b5 = 1.023350_dp

real(kind=dp), parameter, public	g14_a6 = 0.2186240_dp

real(kind=dp), parameter, public	g14_b6 = 1.326440_dp

real(kind=dp), parameter, public	g14_a7 = 0.0700271_dp

real(kind=dp), parameter, public	g14_b7 = 3.483220_dp

real(kind=dp), parameter, public	g14_a8 = 0.1656890_dp

real(kind=dp), parameter, public	g14_b8 = 1.710300_dp

real(kind=dp), parameter, public	g14_a9 = 0.0493301_dp

real(kind=dp), parameter, public	g14_b9 = 4.268870_dp

real(kind=dp), parameter, public	g14_a10 = 0.1254840_dp

real(kind=dp), parameter, public	g14_b10 = 2.190730_dp

real(kind=dp), parameter, public	g14_a11 = 0.0303071_dp

real(kind=dp), parameter, public	g14_b11 = 4.999930_dp

real(kind=dp), parameter, public	g14_a12 = 0.5269670_dp

real(kind=dp), parameter, public	g14_b12 = 0.475269_dp

real(kind=dp), parameter, public	g14_a13 = 0.3496170_dp

real(kind=dp), parameter, public	g14_b13 = 0.397232_dp

real(kind=dp), parameter, public	g14_a14 = 0.4776640_dp

real(kind=dp), parameter, public	g14_b14 = 0.605916_dp

real(kind=dp), parameter, public	g15_rc = 0.10_dp

real(kind=dp), parameter, public	g15_a1 = 1.3606800_dp

real(kind=dp), parameter, public	g15_b1 = 0.310940_dp

real(kind=dp), parameter, public	g15_a2 = 0.0266233_dp

real(kind=dp), parameter, public	g15_b2 = 5.801190_dp

real(kind=dp), parameter, public	g15_a3 = 0.3896280_dp

real(kind=dp), parameter, public	g15_b3 = 0.813967_dp

real(kind=dp), parameter, public	g15_a4 = 0.0155094_dp

real(kind=dp), parameter, public	g15_b4 = 5.800280_dp

real(kind=dp), parameter, public	g15_a5 = 0.5574040_dp

real(kind=dp), parameter, public	g15_b5 = 0.609044_dp

real(kind=dp), parameter, public	g15_a6 = 0.8507370_dp

real(kind=dp), parameter, public	g15_b6 = 0.443840_dp

real(kind=dp), parameter, public	g15_a7 = 0.1590220_dp

real(kind=dp), parameter, public	g15_b7 = 1.808170_dp

real(kind=dp), parameter, public	g15_a8 = 0.2837530_dp

real(kind=dp), parameter, public	g15_b8 = 1.071380_dp

real(kind=dp), parameter, public	g15_a9 = 0.0645391_dp

real(kind=dp), parameter, public	g15_b9 = 3.723390_dp

real(kind=dp), parameter, public	g15_a10 = 0.0241980_dp

real(kind=dp), parameter, public	g15_b10 = 4.946500_dp

real(kind=dp), parameter, public	g15_a11 = 0.0344342_dp

real(kind=dp), parameter, public	g15_b11 = 4.462030_dp

real(kind=dp), parameter, public	g15_a12 = 0.2112170_dp

real(kind=dp), parameter, public	g15_b12 = 1.396840_dp

real(kind=dp), parameter, public	g15_a13 = 0.1202950_dp

real(kind=dp), parameter, public	g15_b13 = 2.325120_dp

real(kind=dp), parameter, public	g15_a14 = 0.0904425_dp

real(kind=dp), parameter, public	g15_b14 = 2.965550_dp

real(kind=dp), parameter, public	g15_a15 = 1.6040000_dp

real(kind=dp), parameter, public	g15_b15 = 0.216434_dp

real(kind=dp), parameter, public	g16_rc = 0.10_dp

real(kind=dp), parameter, public	g16_a1 = 1.5843100_dp

real(kind=dp), parameter, public	g16_b1 = 0.215959_dp

real(kind=dp), parameter, public	g16_a2 = 0.0253725_dp

real(kind=dp), parameter, public	g16_b2 = 5.737070_dp

real(kind=dp), parameter, public	g16_a3 = 0.1191710_dp

real(kind=dp), parameter, public	g16_b3 = 2.233620_dp

real(kind=dp), parameter, public	g16_a4 = 0.2848860_dp

real(kind=dp), parameter, public	g16_b4 = 1.050490_dp

real(kind=dp), parameter, public	g16_a5 = 0.0134257_dp

real(kind=dp), parameter, public	g16_b5 = 5.720440_dp

real(kind=dp), parameter, public	g16_a6 = 0.0269327_dp

real(kind=dp), parameter, public	g16_b6 = 4.542090_dp

real(kind=dp), parameter, public	g16_a7 = 0.0888076_dp

real(kind=dp), parameter, public	g16_b7 = 2.807370_dp

real(kind=dp), parameter, public	g16_a8 = 0.3907140_dp

real(kind=dp), parameter, public	g16_b8 = 0.801210_dp

real(kind=dp), parameter, public	g16_a9 = 0.5584020_dp

real(kind=dp), parameter, public	g16_b9 = 0.601540_dp

real(kind=dp), parameter, public	g16_a10 = 0.0674428_dp

real(kind=dp), parameter, public	g16_b10 = 3.477020_dp

real(kind=dp), parameter, public	g16_a11 = 0.0167448_dp

real(kind=dp), parameter, public	g16_b11 = 5.320770_dp

real(kind=dp), parameter, public	g16_a12 = 0.2120830_dp

real(kind=dp), parameter, public	g16_b12 = 1.363230_dp

real(kind=dp), parameter, public	g16_a13 = 0.0363796_dp

real(kind=dp), parameter, public	g16_b13 = 4.204950_dp

real(kind=dp), parameter, public	g16_a14 = 0.8512990_dp

real(kind=dp), parameter, public	g16_b14 = 0.439692_dp

real(kind=dp), parameter, public	g16_a15 = 0.1591170_dp

real(kind=dp), parameter, public	g16_b15 = 1.753690_dp

real(kind=dp), parameter, public	g16_a16 = 1.3566500_dp

real(kind=dp), parameter, public	g16_b16 = 0.308985_dp

real(kind=dp), parameter, public	g17_rc = 0.10_dp

real(kind=dp), parameter, public	g17_a1 = 0.0286263_dp

real(kind=dp), parameter, public	g17_b1 = 5.897570_dp

real(kind=dp), parameter, public	g17_a2 = 1.3621700_dp

real(kind=dp), parameter, public	g17_b2 = 0.210930_dp

real(kind=dp), parameter, public	g17_a3 = 0.8582340_dp

real(kind=dp), parameter, public	g17_b3 = 0.396804_dp

real(kind=dp), parameter, public	g17_a4 = 0.0918589_dp

real(kind=dp), parameter, public	g17_b4 = 2.514930_dp

real(kind=dp), parameter, public	g17_a5 = 0.2314390_dp

real(kind=dp), parameter, public	g17_b5 = 1.077620_dp

real(kind=dp), parameter, public	g17_a6 = 1.3030900_dp

real(kind=dp), parameter, public	g17_b6 = 0.288252_dp

real(kind=dp), parameter, public	g17_a7 = 0.1437920_dp

real(kind=dp), parameter, public	g17_b7 = 1.658970_dp

real(kind=dp), parameter, public	g17_a8 = 0.3010060_dp

real(kind=dp), parameter, public	g17_b8 = 0.860535_dp

real(kind=dp), parameter, public	g17_a9 = 0.0274321_dp

real(kind=dp), parameter, public	g17_b9 = 5.099500_dp

real(kind=dp), parameter, public	g17_a10 = 0.1814220_dp

real(kind=dp), parameter, public	g17_b10 = 1.340220_dp

real(kind=dp), parameter, public	g17_a11 = 0.4046220_dp

real(kind=dp), parameter, public	g17_b11 = 0.679621_dp

real(kind=dp), parameter, public	g17_a12 = 0.0735338_dp

real(kind=dp), parameter, public	g17_b12 = 3.080580_dp

real(kind=dp), parameter, public	g17_a13 = 0.0577419_dp

real(kind=dp), parameter, public	g17_b13 = 3.752150_dp

real(kind=dp), parameter, public	g17_a14 = 0.0388557_dp

real(kind=dp), parameter, public	g17_b14 = 4.481620_dp

real(kind=dp), parameter, public	g17_a15 = 0.1147140_dp

real(kind=dp), parameter, public	g17_b15 = 2.045960_dp

real(kind=dp), parameter, public	g17_a16 = 0.5719720_dp

real(kind=dp), parameter, public	g17_b16 = 0.526925_dp

real(kind=dp), parameter, public	g17_a17 = 0.0222331_dp

real(kind=dp), parameter, public	g17_b17 = 6.674390_dp

real(kind=dp), parameter, public	g18_rc = 0.10_dp

real(kind=dp), parameter, public	g18_a1 = 0.0326473_dp

real(kind=dp), parameter, public	g18_b1 = 5.962800_dp

real(kind=dp), parameter, public	g18_a2 = 0.0181199_dp

real(kind=dp), parameter, public	g18_b2 = 6.674950_dp

real(kind=dp), parameter, public	g18_a3 = 0.8582970_dp

real(kind=dp), parameter, public	g18_b3 = 0.396103_dp

real(kind=dp), parameter, public	g18_a4 = 0.0880221_dp

real(kind=dp), parameter, public	g18_b4 = 2.468750_dp

real(kind=dp), parameter, public	g18_a5 = 0.1812460_dp

real(kind=dp), parameter, public	g18_b5 = 1.332910_dp

real(kind=dp), parameter, public	g18_a6 = 0.2314380_dp

real(kind=dp), parameter, public	g18_b6 = 1.072960_dp

real(kind=dp), parameter, public	g18_a7 = 0.0449632_dp

real(kind=dp), parameter, public	g18_b7 = 3.435210_dp

real(kind=dp), parameter, public	g18_a8 = 1.3583000_dp

real(kind=dp), parameter, public	g18_b8 = 0.210847_dp

real(kind=dp), parameter, public	g18_a9 = 0.1132310_dp

real(kind=dp), parameter, public	g18_b9 = 2.024200_dp

real(kind=dp), parameter, public	g18_a10 = 0.0251085_dp

real(kind=dp), parameter, public	g18_b10 = 4.226690_dp

real(kind=dp), parameter, public	g18_a11 = 0.4047630_dp

real(kind=dp), parameter, public	g18_b11 = 0.677704_dp

real(kind=dp), parameter, public	g18_a12 = 0.3010870_dp

real(kind=dp), parameter, public	g18_b12 = 0.857535_dp

real(kind=dp), parameter, public	g18_a13 = 1.3019600_dp

real(kind=dp), parameter, public	g18_b13 = 0.287909_dp

real(kind=dp), parameter, public	g18_a14 = 0.1432190_dp

real(kind=dp), parameter, public	g18_b14 = 1.646940_dp

real(kind=dp), parameter, public	g18_a15 = 0.0634725_dp

real(kind=dp), parameter, public	g18_b15 = 2.959960_dp

real(kind=dp), parameter, public	g18_a16 = 0.5721690_dp

real(kind=dp), parameter, public	g18_b16 = 0.525730_dp

real(kind=dp), parameter, public	g18_a17 = 0.0309731_dp

real(kind=dp), parameter, public	g18_b17 = 3.918400_dp

real(kind=dp), parameter, public	g18_a18 = 0.0429091_dp

real(kind=dp), parameter, public	g18_b18 = 4.928750_dp

real(kind=dp), parameter, public	s2_rc = 1.2_dp

real(kind=dp), parameter, public	s2_a1 = 0.1167720_dp

real(kind=dp), parameter, public	s2_b1 = 3.15760_dp

real(kind=dp), parameter, public	s2_a2 = 0.0537459_dp

real(kind=dp), parameter, public	s2_b2 = 1.66713_dp

real(kind=dp), parameter, public	s3_rc = 1.05_dp

real(kind=dp), parameter, public	s3_a1 = 0.1258370_dp

real(kind=dp), parameter, public	s3_b1 = 3.54518_dp

real(kind=dp), parameter, public	s3_a2 = 0.0920562_dp

real(kind=dp), parameter, public	s3_b2 = 2.17201_dp

real(kind=dp), parameter, public	s3_a3 = 0.0354098_dp

real(kind=dp), parameter, public	s3_b3 = 1.16797_dp

real(kind=dp), parameter, public	s4_rc = 0.90_dp

real(kind=dp), parameter, public	s4_a1 = 0.1237040_dp

real(kind=dp), parameter, public	s4_b1 = 3.82356_dp

real(kind=dp), parameter, public	s4_a2 = 0.0263957_dp

real(kind=dp), parameter, public	s4_b2 = 0.84445_dp

real(kind=dp), parameter, public	s4_a3 = 0.0773548_dp

real(kind=dp), parameter, public	s4_b3 = 1.56300_dp

real(kind=dp), parameter, public	s4_a4 = 0.1243300_dp

real(kind=dp), parameter, public	s4_b4 = 2.49568_dp

real(kind=dp), parameter, public	s5_rc = 0.80_dp

real(kind=dp), parameter, public	s5_a1 = 0.0601509_dp

real(kind=dp), parameter, public	s5_b1 = 1.169940_dp

real(kind=dp), parameter, public	s5_a2 = 0.1133640_dp

real(kind=dp), parameter, public	s5_b2 = 1.853660_dp

real(kind=dp), parameter, public	s5_a3 = 0.1120710_dp

real(kind=dp), parameter, public	s5_b3 = 4.084220_dp

real(kind=dp), parameter, public	s5_a4 = 0.1334100_dp

real(kind=dp), parameter, public	s5_b4 = 2.762410_dp

real(kind=dp), parameter, public	s5_a5 = 0.0186655_dp

real(kind=dp), parameter, public	s5_b5 = 0.633305_dp

real(kind=dp), parameter, public	s6_rc = 0.70_dp

real(kind=dp), parameter, public	s6_a1 = 0.0494163_dp

real(kind=dp), parameter, public	s6_b1 = 0.889897_dp

real(kind=dp), parameter, public	s6_a2 = 0.1415590_dp

real(kind=dp), parameter, public	s6_b2 = 2.073620_dp

real(kind=dp), parameter, public	s6_a3 = 0.1311110_dp

real(kind=dp), parameter, public	s6_b3 = 2.977960_dp

real(kind=dp), parameter, public	s6_a4 = 0.1012530_dp

real(kind=dp), parameter, public	s6_b4 = 4.306440_dp

real(kind=dp), parameter, public	s6_a5 = 0.1037040_dp

real(kind=dp), parameter, public	s6_b5 = 1.405500_dp

real(kind=dp), parameter, public	s6_a6 = 0.0144409_dp

real(kind=dp), parameter, public	s6_b6 = 0.482098_dp

real(kind=dp), parameter, public	s7_rc = 0.65_dp

real(kind=dp), parameter, public	s7_a1 = 0.08156290_dp

real(kind=dp), parameter, public	s7_b1 = 1.104000_dp

real(kind=dp), parameter, public	s7_a2 = 0.00971659_dp

real(kind=dp), parameter, public	s7_b2 = 0.379602_dp

real(kind=dp), parameter, public	s7_a3 = 0.09067690_dp

real(kind=dp), parameter, public	s7_b3 = 4.537130_dp

real(kind=dp), parameter, public	s7_a4 = 0.14334400_dp

real(kind=dp), parameter, public	s7_b4 = 2.290480_dp

real(kind=dp), parameter, public	s7_a5 = 0.13012600_dp

real(kind=dp), parameter, public	s7_b5 = 1.619190_dp

real(kind=dp), parameter, public	s7_a6 = 0.11794100_dp

real(kind=dp), parameter, public	s7_b6 = 3.205850_dp

real(kind=dp), parameter, public	s7_a7 = 0.03510960_dp

real(kind=dp), parameter, public	s7_b7 = 0.700361_dp

real(kind=dp), parameter, public	s8_rc = 0.60_dp

real(kind=dp), parameter, public	s8_a1 = 0.14676300_dp

real(kind=dp), parameter, public	s8_b1 = 1.802170_dp

real(kind=dp), parameter, public	s8_a2 = 0.00686211_dp

real(kind=dp), parameter, public	s8_b2 = 0.302201_dp

real(kind=dp), parameter, public	s8_a3 = 0.08248590_dp

real(kind=dp), parameter, public	s8_b3 = 4.741690_dp

real(kind=dp), parameter, public	s8_a4 = 0.10588700_dp

real(kind=dp), parameter, public	s8_b4 = 3.410740_dp

real(kind=dp), parameter, public	s8_a5 = 0.06409090_dp

real(kind=dp), parameter, public	s8_b5 = 0.877859_dp

real(kind=dp), parameter, public	s8_a6 = 0.11461200_dp

real(kind=dp), parameter, public	s8_b6 = 1.283730_dp

real(kind=dp), parameter, public	s8_a7 = 0.13708200_dp

real(kind=dp), parameter, public	s8_b7 = 2.482170_dp

real(kind=dp), parameter, public	s8_a8 = 0.02571900_dp

real(kind=dp), parameter, public	s8_b8 = 0.557431_dp

real(kind=dp), parameter, public	s9_rc = 0.55_dp

real(kind=dp), parameter, public	s9_a1 = 0.0760147_dp

real(kind=dp), parameter, public	s9_b1 = 4.924130_dp

real(kind=dp), parameter, public	s9_a2 = 0.0050867_dp

real(kind=dp), parameter, public	s9_b2 = 0.242656_dp

real(kind=dp), parameter, public	s9_a3 = 0.1524530_dp

real(kind=dp), parameter, public	s9_b3 = 1.962780_dp

real(kind=dp), parameter, public	s9_a4 = 0.0993944_dp

real(kind=dp), parameter, public	s9_b4 = 1.028540_dp

real(kind=dp), parameter, public	s9_a5 = 0.1433380_dp

real(kind=dp), parameter, public	s9_b5 = 1.438020_dp

real(kind=dp), parameter, public	s9_a6 = 0.1267950_dp

real(kind=dp), parameter, public	s9_b6 = 2.655630_dp

real(kind=dp), parameter, public	s9_a7 = 0.0958376_dp

real(kind=dp), parameter, public	s9_b7 = 3.595590_dp

real(kind=dp), parameter, public	s9_a8 = 0.0511698_dp

real(kind=dp), parameter, public	s9_b8 = 0.704455_dp

real(kind=dp), parameter, public	s9_a9 = 0.0195500_dp

real(kind=dp), parameter, public	s9_b9 = 0.447544_dp

real(kind=dp), parameter, public	s10_rc = 0.5_dp

real(kind=dp), parameter, public	s10_a1 = 0.11585200_dp

real(kind=dp), parameter, public	s10_b1 = 2.814420_dp

real(kind=dp), parameter, public	s10_a2 = 0.01551000_dp

real(kind=dp), parameter, public	s10_b2 = 0.361841_dp

real(kind=dp), parameter, public	s10_a3 = 0.08772520_dp

real(kind=dp), parameter, public	s10_b3 = 3.762340_dp

real(kind=dp), parameter, public	s10_a4 = 0.16279600_dp

real(kind=dp), parameter, public	s10_b4 = 1.572690_dp

real(kind=dp), parameter, public	s10_a5 = 0.08664120_dp

real(kind=dp), parameter, public	s10_b5 = 0.830482_dp

real(kind=dp), parameter, public	s10_a6 = 0.13675500_dp

real(kind=dp), parameter, public	s10_b6 = 1.158370_dp

real(kind=dp), parameter, public	s10_a7 = 0.04201910_dp

real(kind=dp), parameter, public	s10_b7 = 0.569340_dp

real(kind=dp), parameter, public	s10_a8 = 0.14880800_dp

real(kind=dp), parameter, public	s10_b8 = 2.107180_dp

real(kind=dp), parameter, public	s10_a9 = 0.07080240_dp

real(kind=dp), parameter, public	s10_b9 = 5.087590_dp

real(kind=dp), parameter, public	s10_a10 = 0.00396733_dp

real(kind=dp), parameter, public	s10_b10 = 0.196230_dp

real(kind=dp), parameter, public	s11_rc = 0.45_dp

real(kind=dp), parameter, public	s11_a1 = 0.16967500_dp

real(kind=dp), parameter, public	s11_b1 = 1.274890_dp

real(kind=dp), parameter, public	s11_a2 = 0.01316070_dp

real(kind=dp), parameter, public	s11_b2 = 0.296680_dp

real(kind=dp), parameter, public	s11_a3 = 0.06640200_dp

real(kind=dp), parameter, public	s11_b3 = 5.239300_dp

real(kind=dp), parameter, public	s11_a4 = 0.10578100_dp

real(kind=dp), parameter, public	s11_b4 = 2.964600_dp

real(kind=dp), parameter, public	s11_a5 = 0.07769660_dp

real(kind=dp), parameter, public	s11_b5 = 0.677602_dp

real(kind=dp), parameter, public	s11_a6 = 0.08097080_dp

real(kind=dp), parameter, public	s11_b6 = 3.917730_dp

real(kind=dp), parameter, public	s11_a7 = 0.16973700_dp

real(kind=dp), parameter, public	s11_b7 = 1.696540_dp

real(kind=dp), parameter, public	s11_a8 = 0.13064000_dp

real(kind=dp), parameter, public	s11_b8 = 0.942777_dp

real(kind=dp), parameter, public	s11_a9 = 0.03627480_dp

real(kind=dp), parameter, public	s11_b9 = 0.465541_dp

real(kind=dp), parameter, public	s11_a10 = 0.13917200_dp

real(kind=dp), parameter, public	s11_b10 = 2.244230_dp

real(kind=dp), parameter, public	s11_a11 = 0.00336822_dp

real(kind=dp), parameter, public	s11_b11 = 0.161548_dp

real(kind=dp), parameter, public	s12_rc = 0.40_dp

real(kind=dp), parameter, public	s12_a1 = 0.09642700_dp

real(kind=dp), parameter, public	s12_b1 = 3.118890_dp

real(kind=dp), parameter, public	s12_a2 = 0.17691800_dp

real(kind=dp), parameter, public	s12_b2 = 1.052170_dp

real(kind=dp), parameter, public	s12_a3 = 0.06232170_dp

real(kind=dp), parameter, public	s12_b3 = 5.393160_dp

real(kind=dp), parameter, public	s12_a4 = 0.01269890_dp

real(kind=dp), parameter, public	s12_b4 = 0.252183_dp

real(kind=dp), parameter, public	s12_a5 = 0.07481830_dp

real(kind=dp), parameter, public	s12_b5 = 4.075740_dp

real(kind=dp), parameter, public	s12_a6 = 0.12917000_dp

real(kind=dp), parameter, public	s12_b6 = 0.782380_dp

real(kind=dp), parameter, public	s12_a7 = 0.03450160_dp

real(kind=dp), parameter, public	s12_b7 = 0.391473_dp

real(kind=dp), parameter, public	s12_a8 = 0.12664700_dp

real(kind=dp), parameter, public	s12_b8 = 2.387640_dp

real(kind=dp), parameter, public	s12_a9 = 0.07450870_dp

real(kind=dp), parameter, public	s12_b9 = 0.565577_dp

real(kind=dp), parameter, public	s12_a10 = 0.18916800_dp

real(kind=dp), parameter, public	s12_b10 = 1.390920_dp

real(kind=dp), parameter, public	s12_a11 = 0.16350600_dp

real(kind=dp), parameter, public	s12_b11 = 1.824470_dp

real(kind=dp), parameter, public	s12_a12 = 0.00339586_dp

real(kind=dp), parameter, public	s12_b12 = 0.139492_dp

real(kind=dp), parameter, public	s13_rc = 0.35_dp

real(kind=dp), parameter, public	s13_a1 = 0.0827110_dp

real(kind=dp), parameter, public	s13_b1 = 3.406540_dp

real(kind=dp), parameter, public	s13_a2 = 0.1088730_dp

real(kind=dp), parameter, public	s13_b2 = 2.646630_dp

real(kind=dp), parameter, public	s13_a3 = 0.0548105_dp

real(kind=dp), parameter, public	s13_b3 = 5.651890_dp

real(kind=dp), parameter, public	s13_a4 = 0.1851320_dp

real(kind=dp), parameter, public	s13_b4 = 1.572120_dp

real(kind=dp), parameter, public	s13_a5 = 0.0153281_dp

real(kind=dp), parameter, public	s13_b5 = 0.227432_dp

real(kind=dp), parameter, public	s13_a6 = 0.1447980_dp

real(kind=dp), parameter, public	s13_b6 = 0.684903_dp

real(kind=dp), parameter, public	s13_a7 = 0.0400841_dp

real(kind=dp), parameter, public	s13_b7 = 0.348420_dp

real(kind=dp), parameter, public	s13_a8 = 0.1976780_dp

real(kind=dp), parameter, public	s13_b8 = 0.915974_dp

real(kind=dp), parameter, public	s13_a9 = 0.0845825_dp

real(kind=dp), parameter, public	s13_b9 = 0.498603_dp

real(kind=dp), parameter, public	s13_a10 = 0.2124150_dp

real(kind=dp), parameter, public	s13_b10 = 1.204860_dp

real(kind=dp), parameter, public	s13_a11 = 0.0643854_dp

real(kind=dp), parameter, public	s13_b11 = 4.368000_dp

real(kind=dp), parameter, public	s13_a12 = 0.1438660_dp

real(kind=dp), parameter, public	s13_b12 = 2.044290_dp

real(kind=dp), parameter, public	s13_a13 = 0.0043540_dp

real(kind=dp), parameter, public	s13_b13 = 0.127923_dp

real(kind=dp), parameter, public	s14_rc = 0.3_dp

real(kind=dp), parameter, public	s14_a1 = 0.1185130_dp

real(kind=dp), parameter, public	s14_b1 = 2.483340_dp

real(kind=dp), parameter, public	s14_a2 = 0.2451880_dp

real(kind=dp), parameter, public	s14_b2 = 1.119610_dp

real(kind=dp), parameter, public	s14_a3 = 0.0585112_dp

real(kind=dp), parameter, public	s14_b3 = 0.327881_dp

real(kind=dp), parameter, public	s14_a4 = 0.2441530_dp

real(kind=dp), parameter, public	s14_b4 = 0.851146_dp

real(kind=dp), parameter, public	s14_a5 = 0.1561530_dp

real(kind=dp), parameter, public	s14_b5 = 1.909900_dp

real(kind=dp), parameter, public	s14_a6 = 0.1178640_dp

real(kind=dp), parameter, public	s14_b6 = 0.466300_dp

real(kind=dp), parameter, public	s14_a7 = 0.0710939_dp

real(kind=dp), parameter, public	s14_b7 = 4.176560_dp

real(kind=dp), parameter, public	s14_a8 = 0.0907698_dp

real(kind=dp), parameter, public	s14_b8 = 3.219580_dp

real(kind=dp), parameter, public	s14_a9 = 0.0298147_dp

real(kind=dp), parameter, public	s14_b9 = 5.495980_dp

real(kind=dp), parameter, public	s14_a10 = 0.0233818_dp

real(kind=dp), parameter, public	s14_b10 = 0.215814_dp

real(kind=dp), parameter, public	s14_a11 = 0.2037940_dp

real(kind=dp), parameter, public	s14_b11 = 1.464080_dp

real(kind=dp), parameter, public	s14_a12 = 0.1909540_dp

real(kind=dp), parameter, public	s14_b12 = 0.637845_dp

real(kind=dp), parameter, public	s14_a13 = 0.0300539_dp

real(kind=dp), parameter, public	s14_b13 = 5.481830_dp

real(kind=dp), parameter, public	s14_a14 = 0.0069580_dp

real(kind=dp), parameter, public	s14_b14 = 0.122528_dp

real(kind=dp), parameter, public	s15_rc = 0.25_dp

real(kind=dp), parameter, public	s15_a1 = 0.0945048_dp

real(kind=dp), parameter, public	s15_b1 = 2.945510_dp

real(kind=dp), parameter, public	s15_a2 = 0.2601310_dp

real(kind=dp), parameter, public	s15_b2 = 0.589258_dp

real(kind=dp), parameter, public	s15_a3 = 0.1267470_dp

real(kind=dp), parameter, public	s15_b3 = 2.288550_dp

real(kind=dp), parameter, public	s15_a4 = 0.0389633_dp

real(kind=dp), parameter, public	s15_b4 = 0.203996_dp

real(kind=dp), parameter, public	s15_a5 = 0.1688290_dp

real(kind=dp), parameter, public	s15_b5 = 1.763470_dp

real(kind=dp), parameter, public	s15_a6 = 0.2822050_dp

real(kind=dp), parameter, public	s15_b6 = 1.031520_dp

real(kind=dp), parameter, public	s15_a7 = 0.3048940_dp

real(kind=dp), parameter, public	s15_b7 = 0.784165_dp

real(kind=dp), parameter, public	s15_a8 = 0.0262863_dp

real(kind=dp), parameter, public	s15_b8 = 5.598990_dp

real(kind=dp), parameter, public	s15_a9 = 0.0231427_dp

real(kind=dp), parameter, public	s15_b9 = 5.844390_dp

real(kind=dp), parameter, public	s15_a10 = 0.0484052_dp

real(kind=dp), parameter, public	s15_b10 = 4.606440_dp

real(kind=dp), parameter, public	s15_a11 = 0.0680845_dp

real(kind=dp), parameter, public	s15_b11 = 3.734880_dp

real(kind=dp), parameter, public	s15_a12 = 0.0918188_dp

real(kind=dp), parameter, public	s15_b12 = 0.306903_dp

real(kind=dp), parameter, public	s15_a13 = 0.2236530_dp

real(kind=dp), parameter, public	s15_b13 = 1.351070_dp

real(kind=dp), parameter, public	s15_a14 = 0.1732960_dp

real(kind=dp), parameter, public	s15_b14 = 0.433086_dp

real(kind=dp), parameter, public	s15_a15 = 0.0122787_dp

real(kind=dp), parameter, public	s15_b15 = 0.116976_dp

real(kind=dp), parameter, public	s16_rc = 0.20_dp

real(kind=dp), parameter, public	s16_a1 = 0.0355363_dp

real(kind=dp), parameter, public	s16_b1 = 5.119830_dp

real(kind=dp), parameter, public	s16_a2 = 0.0250461_dp

real(kind=dp), parameter, public	s16_b2 = 0.111228_dp

real(kind=dp), parameter, public	s16_a3 = 0.0555360_dp

real(kind=dp), parameter, public	s16_b3 = 4.232680_dp

real(kind=dp), parameter, public	s16_a4 = 0.0747956_dp

real(kind=dp), parameter, public	s16_b4 = 3.406690_dp

real(kind=dp), parameter, public	s16_a5 = 0.0739676_dp

real(kind=dp), parameter, public	s16_b5 = 0.192075_dp

real(kind=dp), parameter, public	s16_a6 = 0.1016150_dp

real(kind=dp), parameter, public	s16_b6 = 2.694530_dp

real(kind=dp), parameter, public	s16_a7 = 0.1600940_dp

real(kind=dp), parameter, public	s16_b7 = 0.285880_dp

real(kind=dp), parameter, public	s16_a8 = 0.3823200_dp

real(kind=dp), parameter, public	s16_b8 = 0.717807_dp

real(kind=dp), parameter, public	s16_a9 = 0.0174934_dp

real(kind=dp), parameter, public	s16_b9 = 5.965260_dp

real(kind=dp), parameter, public	s16_a10 = 0.1369610_dp

real(kind=dp), parameter, public	s16_b10 = 2.100230_dp

real(kind=dp), parameter, public	s16_a11 = 0.1835200_dp

real(kind=dp), parameter, public	s16_b11 = 1.620280_dp

real(kind=dp), parameter, public	s16_a12 = 0.2453470_dp

real(kind=dp), parameter, public	s16_b12 = 1.240770_dp

real(kind=dp), parameter, public	s16_a13 = 0.3219940_dp

real(kind=dp), parameter, public	s16_b13 = 0.945350_dp

real(kind=dp), parameter, public	s16_a14 = 0.0174978_dp

real(kind=dp), parameter, public	s16_b14 = 5.965260_dp

real(kind=dp), parameter, public	s16_a15 = 0.3677700_dp

real(kind=dp), parameter, public	s16_b15 = 0.540682_dp

real(kind=dp), parameter, public	s16_a16 = 0.2742210_dp

real(kind=dp), parameter, public	s16_b16 = 0.399796_dp

real(kind=dp), parameter, public	s17_rc = 0.15_dp

real(kind=dp), parameter, public	s17_a1 = 0.0844127_dp

real(kind=dp), parameter, public	s17_b1 = 3.242020_dp

real(kind=dp), parameter, public	s17_a2 = 0.5321910_dp

real(kind=dp), parameter, public	s17_b2 = 0.495959_dp

real(kind=dp), parameter, public	s17_a3 = 0.4682070_dp

real(kind=dp), parameter, public	s17_b3 = 0.659162_dp

real(kind=dp), parameter, public	s17_a4 = 0.0316333_dp

real(kind=dp), parameter, public	s17_b4 = 4.520730_dp

real(kind=dp), parameter, public	s17_a5 = 0.1497940_dp

real(kind=dp), parameter, public	s17_b5 = 1.957400_dp

real(kind=dp), parameter, public	s17_a6 = 0.0181484_dp

real(kind=dp), parameter, public	s17_b6 = 5.592050_dp

real(kind=dp), parameter, public	s17_a7 = 0.0181805_dp

real(kind=dp), parameter, public	s17_b7 = 5.592050_dp

real(kind=dp), parameter, public	s17_a8 = 0.4758870_dp

real(kind=dp), parameter, public	s17_b8 = 0.368353_dp

real(kind=dp), parameter, public	s17_a9 = 0.0474720_dp

real(kind=dp), parameter, public	s17_b9 = 4.043220_dp

real(kind=dp), parameter, public	s17_a10 = 0.2678960_dp

real(kind=dp), parameter, public	s17_b10 = 1.148850_dp

real(kind=dp), parameter, public	s17_a11 = 0.1998770_dp

real(kind=dp), parameter, public	s17_b11 = 1.504430_dp

real(kind=dp), parameter, public	s17_a12 = 0.0181970_dp

real(kind=dp), parameter, public	s17_b12 = 5.592050_dp

real(kind=dp), parameter, public	s17_a13 = 0.3261780_dp

real(kind=dp), parameter, public	s17_b13 = 0.265656_dp

real(kind=dp), parameter, public	s17_a14 = 0.1720050_dp

real(kind=dp), parameter, public	s17_b14 = 0.180302_dp

real(kind=dp), parameter, public	s17_a15 = 0.1127310_dp

real(kind=dp), parameter, public	s17_b15 = 2.529320_dp

real(kind=dp), parameter, public	s17_a16 = 0.3595840_dp

real(kind=dp), parameter, public	s17_b16 = 0.872121_dp

real(kind=dp), parameter, public	s17_a17 = 0.0642967_dp

real(kind=dp), parameter, public	s17_b17 = 0.105311_dp

real(kind=dp), parameter, public	s18_rc = 0.05_dp

real(kind=dp), parameter, public	s18_a1 = 0.1013430_dp

real(kind=dp), parameter, public	s18_b1 = 0.0270641_dp

real(kind=dp), parameter, public	s18_a2 = 0.0583885_dp

real(kind=dp), parameter, public	s18_b2 = 4.2001100_dp

real(kind=dp), parameter, public	s18_a3 = 1.1587600_dp

real(kind=dp), parameter, public	s18_b3 = 0.3072560_dp

real(kind=dp), parameter, public	s18_a4 = 0.1255030_dp

real(kind=dp), parameter, public	s18_b4 = 2.3069300_dp

real(kind=dp), parameter, public	s18_a5 = 0.0469195_dp

real(kind=dp), parameter, public	s18_b5 = 3.5331200_dp

real(kind=dp), parameter, public	s18_a6 = 0.3728020_dp

real(kind=dp), parameter, public	s18_b6 = 0.0498868_dp

real(kind=dp), parameter, public	s18_a7 = 0.8990960_dp

real(kind=dp), parameter, public	s18_b7 = 0.0785500_dp

real(kind=dp), parameter, public	s18_a8 = 0.3146440_dp

real(kind=dp), parameter, public	s18_b8 = 1.0197600_dp

real(kind=dp), parameter, public	s18_a9 = 1.5250400_dp

real(kind=dp), parameter, public	s18_b9 = 0.1149420_dp

real(kind=dp), parameter, public	s18_a10 = 0.4308660_dp

real(kind=dp), parameter, public	s18_b10 = 0.7644820_dp

real(kind=dp), parameter, public	s18_a11 = 0.8278010_dp

real(kind=dp), parameter, public	s18_b11 = 0.4197150_dp

real(kind=dp), parameter, public	s18_a12 = 0.5947340_dp

real(kind=dp), parameter, public	s18_b12 = 0.5687230_dp

real(kind=dp), parameter, public	s18_a13 = 1.5771300_dp

real(kind=dp), parameter, public	s18_b13 = 0.2235160_dp

real(kind=dp), parameter, public	s18_a14 = 0.1707930_dp

real(kind=dp), parameter, public	s18_b14 = 1.7733300_dp

real(kind=dp), parameter, public	s18_a15 = 1.8160800_dp

real(kind=dp), parameter, public	s18_b15 = 0.1616990_dp

real(kind=dp), parameter, public	s18_a16 = 0.0857559_dp

real(kind=dp), parameter, public	s18_b16 = 2.9441700_dp

real(kind=dp), parameter, public	s18_a17 = 0.2313250_dp

real(kind=dp), parameter, public	s18_b17 = 1.3500600_dp

real(kind=dp), parameter, public	s18_a18 = 0.0593302_dp

real(kind=dp), parameter, public	s18_b18 = 5.4023800_dp

Detailed Description

GEEP coefficients for fixed radii. THIS IS THE GEEP LIB. They can be used together with the "omotetia" rule for erf function to obtain the expansion for whatever radius one desires Radius value are in Angstrom.

History: 7.2005 created [tlaino]

Author: Teodoro Laino

Variable Documentation

◆ min_geep_lib_gauss

integer, parameter, public qmmm_gaussian_data::min_geep_lib_gauss = 2

Definition at line 26 of file qmmm_gaussian_data.F.

◆ max_geep_lib_gauss

integer, parameter, public qmmm_gaussian_data::max_geep_lib_gauss = 18

Definition at line 27 of file qmmm_gaussian_data.F.

◆ g2_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g2_rc = 1.30_dp

Definition at line 29 of file qmmm_gaussian_data.F.

◆ g2_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g2_a1 = 0.121492_dp

Definition at line 30 of file qmmm_gaussian_data.F.

◆ g2_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g2_b1 = 3.85695_dp

Definition at line 30 of file qmmm_gaussian_data.F.

◆ g2_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g2_a2 = 0.104509_dp

Definition at line 31 of file qmmm_gaussian_data.F.

◆ g2_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g2_b2 = 2.72971_dp

Definition at line 31 of file qmmm_gaussian_data.F.

◆ g3_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g3_rc = 1.17_dp

Definition at line 33 of file qmmm_gaussian_data.F.

◆ g3_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g3_a1 = 0.1142400_dp

Definition at line 34 of file qmmm_gaussian_data.F.

◆ g3_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g3_b1 = 3.08635_dp

Definition at line 34 of file qmmm_gaussian_data.F.

◆ g3_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g3_a2 = 0.0867876_dp

Definition at line 35 of file qmmm_gaussian_data.F.

◆ g3_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g3_b2 = 2.38345_dp

Definition at line 35 of file qmmm_gaussian_data.F.

◆ g3_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g3_a3 = 0.0971514_dp

Definition at line 36 of file qmmm_gaussian_data.F.

◆ g3_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g3_b3 = 4.35065_dp

Definition at line 36 of file qmmm_gaussian_data.F.

◆ g4_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g4_rc = 1.05_dp

Definition at line 38 of file qmmm_gaussian_data.F.

◆ g4_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g4_a1 = 0.0776927_dp

Definition at line 39 of file qmmm_gaussian_data.F.

◆ g4_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g4_b1 = 2.10429_dp

Definition at line 39 of file qmmm_gaussian_data.F.

◆ g4_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g4_a2 = 0.1123350_dp

Definition at line 40 of file qmmm_gaussian_data.F.

◆ g4_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g4_b2 = 2.59523_dp

Definition at line 40 of file qmmm_gaussian_data.F.

◆ g4_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g4_a3 = 0.0812506_dp

Definition at line 41 of file qmmm_gaussian_data.F.

◆ g4_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g4_b3 = 4.73860_dp

Definition at line 41 of file qmmm_gaussian_data.F.

◆ g4_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g4_a4 = 0.0989222_dp

Definition at line 42 of file qmmm_gaussian_data.F.

◆ g4_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g4_b4 = 3.44579_dp

Definition at line 42 of file qmmm_gaussian_data.F.

◆ g5_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g5_rc = 0.9_dp

Definition at line 44 of file qmmm_gaussian_data.F.

◆ g5_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g5_a1 = 0.0728205_dp

Definition at line 45 of file qmmm_gaussian_data.F.

◆ g5_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g5_b1 = 4.98419_dp

Definition at line 45 of file qmmm_gaussian_data.F.

◆ g5_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g5_a2 = 0.0797713_dp

Definition at line 46 of file qmmm_gaussian_data.F.

◆ g5_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g5_b2 = 1.78985_dp

Definition at line 46 of file qmmm_gaussian_data.F.

◆ g5_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g5_a3 = 0.0885763_dp

Definition at line 47 of file qmmm_gaussian_data.F.

◆ g5_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g5_b3 = 3.68614_dp

Definition at line 47 of file qmmm_gaussian_data.F.

◆ g5_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g5_a4 = 0.1104310_dp

Definition at line 48 of file qmmm_gaussian_data.F.

◆ g5_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g5_b4 = 2.78214_dp

Definition at line 48 of file qmmm_gaussian_data.F.

◆ g5_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g5_a5 = 0.1211280_dp

Definition at line 49 of file qmmm_gaussian_data.F.

◆ g5_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g5_b5 = 2.15508_dp

Definition at line 49 of file qmmm_gaussian_data.F.

◆ g6_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g6_rc = 0.9_dp

Definition at line 51 of file qmmm_gaussian_data.F.

◆ g6_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g6_a1 = 0.0863850_dp

Definition at line 52 of file qmmm_gaussian_data.F.

◆ g6_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g6_b1 = 3.20872_dp

Definition at line 52 of file qmmm_gaussian_data.F.

◆ g6_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g6_a2 = 0.0704031_dp

Definition at line 53 of file qmmm_gaussian_data.F.

◆ g6_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g6_b2 = 4.12508_dp

Definition at line 53 of file qmmm_gaussian_data.F.

◆ g6_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g6_a3 = 0.0604464_dp

Definition at line 54 of file qmmm_gaussian_data.F.

◆ g6_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g6_b3 = 5.40108_dp

Definition at line 54 of file qmmm_gaussian_data.F.

◆ g6_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g6_a4 = 0.1029610_dp

Definition at line 55 of file qmmm_gaussian_data.F.

◆ g6_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g6_b4 = 2.04751_dp

Definition at line 55 of file qmmm_gaussian_data.F.

◆ g6_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g6_a5 = 0.1020950_dp

Definition at line 56 of file qmmm_gaussian_data.F.

◆ g6_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g6_b5 = 2.52820_dp

Definition at line 56 of file qmmm_gaussian_data.F.

◆ g6_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g6_a6 = 0.0621064_dp

Definition at line 57 of file qmmm_gaussian_data.F.

◆ g6_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g6_b6 = 1.76831_dp

Definition at line 57 of file qmmm_gaussian_data.F.

◆ g7_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g7_rc = 0.85_dp

Definition at line 59 of file qmmm_gaussian_data.F.

◆ g7_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g7_a1 = 0.0969005_dp

Definition at line 60 of file qmmm_gaussian_data.F.

◆ g7_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g7_b1 = 1.88076_dp

Definition at line 60 of file qmmm_gaussian_data.F.

◆ g7_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g7_a2 = 0.0556821_dp

Definition at line 61 of file qmmm_gaussian_data.F.

◆ g7_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g7_b2 = 1.65955_dp

Definition at line 61 of file qmmm_gaussian_data.F.

◆ g7_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g7_a3 = 0.0607934_dp

Definition at line 62 of file qmmm_gaussian_data.F.

◆ g7_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g7_b3 = 4.42485_dp

Definition at line 62 of file qmmm_gaussian_data.F.

◆ g7_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g7_a4 = 0.0888440_dp

Definition at line 63 of file qmmm_gaussian_data.F.

◆ g7_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g7_b4 = 2.79941_dp

Definition at line 63 of file qmmm_gaussian_data.F.

◆ g7_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g7_a5 = 0.0535919_dp

Definition at line 64 of file qmmm_gaussian_data.F.

◆ g7_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g7_b5 = 5.68373_dp

Definition at line 64 of file qmmm_gaussian_data.F.

◆ g7_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g7_a6 = 0.0736222_dp

Definition at line 65 of file qmmm_gaussian_data.F.

◆ g7_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g7_b6 = 3.50534_dp

Definition at line 65 of file qmmm_gaussian_data.F.

◆ g7_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g7_a7 = 0.1011310_dp

Definition at line 66 of file qmmm_gaussian_data.F.

◆ g7_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g7_b7 = 2.26261_dp

Definition at line 66 of file qmmm_gaussian_data.F.

◆ g8_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g8_rc = 0.80_dp

Definition at line 68 of file qmmm_gaussian_data.F.

◆ g8_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g8_a1 = 0.0557370_dp

Definition at line 69 of file qmmm_gaussian_data.F.

◆ g8_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g8_b1 = 1.55883_dp

Definition at line 69 of file qmmm_gaussian_data.F.

◆ g8_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g8_a2 = 0.0450800_dp

Definition at line 70 of file qmmm_gaussian_data.F.

◆ g8_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g8_b2 = 6.02024_dp

Definition at line 70 of file qmmm_gaussian_data.F.

◆ g8_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g8_a3 = 0.0496262_dp

Definition at line 71 of file qmmm_gaussian_data.F.

◆ g8_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g8_b3 = 4.82212_dp

Definition at line 71 of file qmmm_gaussian_data.F.

◆ g8_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g8_a4 = 0.0757863_dp

Definition at line 72 of file qmmm_gaussian_data.F.

◆ g8_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g8_b4 = 3.16120_dp

Definition at line 72 of file qmmm_gaussian_data.F.

◆ g8_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g8_a5 = 0.0608617_dp

Definition at line 73 of file qmmm_gaussian_data.F.

◆ g8_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g8_b5 = 3.90652_dp

Definition at line 73 of file qmmm_gaussian_data.F.

◆ g8_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g8_a6 = 0.1040810_dp

Definition at line 74 of file qmmm_gaussian_data.F.

◆ g8_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g8_b6 = 2.09075_dp

Definition at line 74 of file qmmm_gaussian_data.F.

◆ g8_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g8_a7 = 0.0983610_dp

Definition at line 75 of file qmmm_gaussian_data.F.

◆ g8_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g8_b7 = 1.75423_dp

Definition at line 75 of file qmmm_gaussian_data.F.

◆ g8_a8

real(kind=dp), parameter, public qmmm_gaussian_data::g8_a8 = 0.0920273_dp

Definition at line 76 of file qmmm_gaussian_data.F.

◆ g8_b8

real(kind=dp), parameter, public qmmm_gaussian_data::g8_b8 = 2.55933_dp

Definition at line 76 of file qmmm_gaussian_data.F.

◆ g9_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g9_rc = 0.70_dp

Definition at line 78 of file qmmm_gaussian_data.F.

◆ g9_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g9_a1 = 0.1152140_dp

Definition at line 79 of file qmmm_gaussian_data.F.

◆ g9_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g9_b1 = 1.54224_dp

Definition at line 79 of file qmmm_gaussian_data.F.

◆ g9_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g9_a2 = 0.0280838_dp

Definition at line 80 of file qmmm_gaussian_data.F.

◆ g9_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g9_b2 = 5.91022_dp

Definition at line 80 of file qmmm_gaussian_data.F.

◆ g9_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g9_a3 = 0.0718097_dp

Definition at line 81 of file qmmm_gaussian_data.F.

◆ g9_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g9_b3 = 3.54224_dp

Definition at line 81 of file qmmm_gaussian_data.F.

◆ g9_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g9_a4 = 0.0585113_dp

Definition at line 82 of file qmmm_gaussian_data.F.

◆ g9_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g9_b4 = 4.44860_dp

Definition at line 82 of file qmmm_gaussian_data.F.

◆ g9_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g9_a5 = 0.1068470_dp

Definition at line 83 of file qmmm_gaussian_data.F.

◆ g9_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g9_b5 = 2.27491_dp

Definition at line 83 of file qmmm_gaussian_data.F.

◆ g9_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g9_a6 = 0.0883974_dp

Definition at line 84 of file qmmm_gaussian_data.F.

◆ g9_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g9_b6 = 2.83230_dp

Definition at line 84 of file qmmm_gaussian_data.F.

◆ g9_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g9_a7 = 0.1211100_dp

Definition at line 85 of file qmmm_gaussian_data.F.

◆ g9_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g9_b7 = 1.84735_dp

Definition at line 85 of file qmmm_gaussian_data.F.

◆ g9_a8

real(kind=dp), parameter, public qmmm_gaussian_data::g9_a8 = 0.0273353_dp

Definition at line 86 of file qmmm_gaussian_data.F.

◆ g9_b8

real(kind=dp), parameter, public qmmm_gaussian_data::g9_b8 = 5.52297_dp

Definition at line 86 of file qmmm_gaussian_data.F.

◆ g9_a9

real(kind=dp), parameter, public qmmm_gaussian_data::g9_a9 = 0.0657478_dp

Definition at line 87 of file qmmm_gaussian_data.F.

◆ g9_b9

real(kind=dp), parameter, public qmmm_gaussian_data::g9_b9 = 1.36539_dp

Definition at line 87 of file qmmm_gaussian_data.F.

◆ g10_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g10_rc = 0.60_dp

Definition at line 89 of file qmmm_gaussian_data.F.

◆ g10_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g10_a1 = 0.1005460_dp

Definition at line 90 of file qmmm_gaussian_data.F.

◆ g10_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g10_b1 = 2.49407_dp

Definition at line 90 of file qmmm_gaussian_data.F.

◆ g10_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g10_a2 = 0.1246370_dp

Definition at line 91 of file qmmm_gaussian_data.F.

◆ g10_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g10_b2 = 1.99718_dp

Definition at line 91 of file qmmm_gaussian_data.F.

◆ g10_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g10_a3 = 0.0492434_dp

Definition at line 92 of file qmmm_gaussian_data.F.

◆ g10_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g10_b3 = 4.70767_dp

Definition at line 92 of file qmmm_gaussian_data.F.

◆ g10_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g10_a4 = 0.0785904_dp

Definition at line 93 of file qmmm_gaussian_data.F.

◆ g10_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g10_b4 = 3.10735_dp

Definition at line 93 of file qmmm_gaussian_data.F.

◆ g10_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g10_a5 = 0.0242791_dp

Definition at line 94 of file qmmm_gaussian_data.F.

◆ g10_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g10_b5 = 5.81268_dp

Definition at line 94 of file qmmm_gaussian_data.F.

◆ g10_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g10_a6 = 0.0229056_dp

Definition at line 95 of file qmmm_gaussian_data.F.

◆ g10_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g10_b6 = 5.92886_dp

Definition at line 95 of file qmmm_gaussian_data.F.

◆ g10_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g10_a7 = 0.0606229_dp

Definition at line 96 of file qmmm_gaussian_data.F.

◆ g10_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g10_b7 = 3.83892_dp

Definition at line 96 of file qmmm_gaussian_data.F.

◆ g10_a8

real(kind=dp), parameter, public qmmm_gaussian_data::g10_a8 = 0.1442920_dp

Definition at line 97 of file qmmm_gaussian_data.F.

◆ g10_b8

real(kind=dp), parameter, public qmmm_gaussian_data::g10_b8 = 1.61113_dp

Definition at line 97 of file qmmm_gaussian_data.F.

◆ g10_a9

real(kind=dp), parameter, public qmmm_gaussian_data::g10_a9 = 0.0814189_dp

Definition at line 98 of file qmmm_gaussian_data.F.

◆ g10_b9

real(kind=dp), parameter, public qmmm_gaussian_data::g10_b9 = 1.17276_dp

Definition at line 98 of file qmmm_gaussian_data.F.

◆ g10_a10

real(kind=dp), parameter, public qmmm_gaussian_data::g10_a10 = 0.1401800_dp

Definition at line 99 of file qmmm_gaussian_data.F.

◆ g10_b10

real(kind=dp), parameter, public qmmm_gaussian_data::g10_b10 = 1.33402_dp

Definition at line 99 of file qmmm_gaussian_data.F.

◆ g11_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g11_rc = 0.50_dp

Definition at line 101 of file qmmm_gaussian_data.F.

◆ g11_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g11_a1 = 0.1041690_dp

Definition at line 102 of file qmmm_gaussian_data.F.

◆ g11_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g11_b1 = 0.979627_dp

Definition at line 102 of file qmmm_gaussian_data.F.

◆ g11_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g11_a2 = 0.0271666_dp

Definition at line 103 of file qmmm_gaussian_data.F.

◆ g11_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g11_b2 = 5.799740_dp

Definition at line 103 of file qmmm_gaussian_data.F.

◆ g11_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g11_a3 = 0.0200111_dp

Definition at line 104 of file qmmm_gaussian_data.F.

◆ g11_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g11_b3 = 5.799660_dp

Definition at line 104 of file qmmm_gaussian_data.F.

◆ g11_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g11_a4 = 0.0483906_dp

Definition at line 105 of file qmmm_gaussian_data.F.

◆ g11_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g11_b4 = 4.203330_dp

Definition at line 105 of file qmmm_gaussian_data.F.

◆ g11_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g11_a5 = 0.1777430_dp

Definition at line 106 of file qmmm_gaussian_data.F.

◆ g11_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g11_b5 = 1.370190_dp

Definition at line 106 of file qmmm_gaussian_data.F.

◆ g11_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g11_a6 = 0.0731972_dp

Definition at line 107 of file qmmm_gaussian_data.F.

◆ g11_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g11_b6 = 3.415900_dp

Definition at line 107 of file qmmm_gaussian_data.F.

◆ g11_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g11_a7 = 0.0950076_dp

Definition at line 108 of file qmmm_gaussian_data.F.

◆ g11_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g11_b7 = 2.724470_dp

Definition at line 108 of file qmmm_gaussian_data.F.

◆ g11_a8

real(kind=dp), parameter, public qmmm_gaussian_data::g11_a8 = 0.0295802_dp

Definition at line 109 of file qmmm_gaussian_data.F.

◆ g11_b8

real(kind=dp), parameter, public qmmm_gaussian_data::g11_b8 = 4.825220_dp

Definition at line 109 of file qmmm_gaussian_data.F.

◆ g11_a9

real(kind=dp), parameter, public qmmm_gaussian_data::g11_a9 = 0.1212380_dp

Definition at line 110 of file qmmm_gaussian_data.F.

◆ g11_b9

real(kind=dp), parameter, public qmmm_gaussian_data::g11_b9 = 2.162170_dp

Definition at line 110 of file qmmm_gaussian_data.F.

◆ g11_a10

real(kind=dp), parameter, public qmmm_gaussian_data::g11_a10 = 0.1513510_dp

Definition at line 111 of file qmmm_gaussian_data.F.

◆ g11_b10

real(kind=dp), parameter, public qmmm_gaussian_data::g11_b10 = 1.714860_dp

Definition at line 111 of file qmmm_gaussian_data.F.

◆ g11_a11

real(kind=dp), parameter, public qmmm_gaussian_data::g11_a11 = 0.1760780_dp

Definition at line 112 of file qmmm_gaussian_data.F.

◆ g11_b11

real(kind=dp), parameter, public qmmm_gaussian_data::g11_b11 = 1.123400_dp

Definition at line 112 of file qmmm_gaussian_data.F.

◆ g12_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g12_rc = 0.40_dp

Definition at line 114 of file qmmm_gaussian_data.F.

◆ g12_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a1 = 0.1420750_dp

Definition at line 115 of file qmmm_gaussian_data.F.

◆ g12_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b1 = 0.786470_dp

Definition at line 115 of file qmmm_gaussian_data.F.

◆ g12_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a2 = 0.0880114_dp

Definition at line 116 of file qmmm_gaussian_data.F.

◆ g12_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b2 = 2.942550_dp

Definition at line 116 of file qmmm_gaussian_data.F.

◆ g12_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a3 = 0.0645509_dp

Definition at line 117 of file qmmm_gaussian_data.F.

◆ g12_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b3 = 3.669640_dp

Definition at line 117 of file qmmm_gaussian_data.F.

◆ g12_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a4 = 0.1505330_dp

Definition at line 118 of file qmmm_gaussian_data.F.

◆ g12_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b4 = 1.826690_dp

Definition at line 118 of file qmmm_gaussian_data.F.

◆ g12_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a5 = 0.0183100_dp

Definition at line 119 of file qmmm_gaussian_data.F.

◆ g12_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b5 = 5.965520_dp

Definition at line 119 of file qmmm_gaussian_data.F.

◆ g12_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a6 = 0.0182645_dp

Definition at line 120 of file qmmm_gaussian_data.F.

◆ g12_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b6 = 5.965520_dp

Definition at line 120 of file qmmm_gaussian_data.F.

◆ g12_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a7 = 0.1160340_dp

Definition at line 121 of file qmmm_gaussian_data.F.

◆ g12_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b7 = 2.326450_dp

Definition at line 121 of file qmmm_gaussian_data.F.

◆ g12_a8

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a8 = 0.0449121_dp

Definition at line 122 of file qmmm_gaussian_data.F.

◆ g12_b8

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b8 = 4.458350_dp

Definition at line 122 of file qmmm_gaussian_data.F.

◆ g12_a9

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a9 = 0.0264801_dp

Definition at line 123 of file qmmm_gaussian_data.F.

◆ g12_b9

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b9 = 5.182710_dp

Definition at line 123 of file qmmm_gaussian_data.F.

◆ g12_a10

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a10 = 0.2338230_dp

Definition at line 124 of file qmmm_gaussian_data.F.

◆ g12_b10

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b10 = 0.912631_dp

Definition at line 124 of file qmmm_gaussian_data.F.

◆ g12_a11

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a11 = 0.2295300_dp

Definition at line 125 of file qmmm_gaussian_data.F.

◆ g12_b11

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b11 = 1.128850_dp

Definition at line 125 of file qmmm_gaussian_data.F.

◆ g12_a12

real(kind=dp), parameter, public qmmm_gaussian_data::g12_a12 = 0.1911980_dp

Definition at line 126 of file qmmm_gaussian_data.F.

◆ g12_b12

real(kind=dp), parameter, public qmmm_gaussian_data::g12_b12 = 1.431550_dp

Definition at line 126 of file qmmm_gaussian_data.F.

◆ g13_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g13_rc = 0.30_dp

Definition at line 128 of file qmmm_gaussian_data.F.

◆ g13_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a1 = 0.2001960_dp

Definition at line 129 of file qmmm_gaussian_data.F.

◆ g13_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b1 = 0.591285_dp

Definition at line 129 of file qmmm_gaussian_data.F.

◆ g13_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a2 = 0.0884682_dp

Definition at line 130 of file qmmm_gaussian_data.F.

◆ g13_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b2 = 2.958380_dp

Definition at line 130 of file qmmm_gaussian_data.F.

◆ g13_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a3 = 0.1999450_dp

Definition at line 131 of file qmmm_gaussian_data.F.

◆ g13_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b3 = 1.420640_dp

Definition at line 131 of file qmmm_gaussian_data.F.

◆ g13_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a4 = 0.3235490_dp

Definition at line 132 of file qmmm_gaussian_data.F.

◆ g13_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b4 = 0.691636_dp

Definition at line 132 of file qmmm_gaussian_data.F.

◆ g13_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a5 = 0.0636926_dp

Definition at line 133 of file qmmm_gaussian_data.F.

◆ g13_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b5 = 3.693610_dp

Definition at line 133 of file qmmm_gaussian_data.F.

◆ g13_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a6 = 0.0409795_dp

Definition at line 134 of file qmmm_gaussian_data.F.

◆ g13_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b6 = 4.450810_dp

Definition at line 134 of file qmmm_gaussian_data.F.

◆ g13_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a7 = 0.1172330_dp

Definition at line 135 of file qmmm_gaussian_data.F.

◆ g13_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b7 = 2.332480_dp

Definition at line 135 of file qmmm_gaussian_data.F.

◆ g13_a8

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a8 = 0.0278787_dp

Definition at line 136 of file qmmm_gaussian_data.F.

◆ g13_b8

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b8 = 5.119550_dp

Definition at line 136 of file qmmm_gaussian_data.F.

◆ g13_a9

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a9 = 0.0187190_dp

Definition at line 137 of file qmmm_gaussian_data.F.

◆ g13_b9

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b9 = 5.952110_dp

Definition at line 137 of file qmmm_gaussian_data.F.

◆ g13_a10

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a10 = 0.0187159_dp

Definition at line 138 of file qmmm_gaussian_data.F.

◆ g13_b10

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b10 = 5.952110_dp

Definition at line 138 of file qmmm_gaussian_data.F.

◆ g13_a11

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a11 = 0.3118340_dp

Definition at line 139 of file qmmm_gaussian_data.F.

◆ g13_b11

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b11 = 0.863435_dp

Definition at line 139 of file qmmm_gaussian_data.F.

◆ g13_a12

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a12 = 0.2562320_dp

Definition at line 140 of file qmmm_gaussian_data.F.

◆ g13_b12

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b12 = 1.104410_dp

Definition at line 140 of file qmmm_gaussian_data.F.

◆ g13_a13

real(kind=dp), parameter, public qmmm_gaussian_data::g13_a13 = 0.1535690_dp

Definition at line 141 of file qmmm_gaussian_data.F.

◆ g13_b13

real(kind=dp), parameter, public qmmm_gaussian_data::g13_b13 = 1.824620_dp

Definition at line 141 of file qmmm_gaussian_data.F.

◆ g14_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g14_rc = 0.20_dp

Definition at line 143 of file qmmm_gaussian_data.F.

◆ g14_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a1 = 0.3778350_dp

Definition at line 144 of file qmmm_gaussian_data.F.

◆ g14_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b1 = 0.786779_dp

Definition at line 144 of file qmmm_gaussian_data.F.

◆ g14_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a2 = 0.0944711_dp

Definition at line 145 of file qmmm_gaussian_data.F.

◆ g14_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b2 = 2.781090_dp

Definition at line 145 of file qmmm_gaussian_data.F.

◆ g14_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a3 = 0.0204159_dp

Definition at line 146 of file qmmm_gaussian_data.F.

◆ g14_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b3 = 5.876050_dp

Definition at line 146 of file qmmm_gaussian_data.F.

◆ g14_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a4 = 0.0204239_dp

Definition at line 147 of file qmmm_gaussian_data.F.

◆ g14_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b4 = 5.876050_dp

Definition at line 147 of file qmmm_gaussian_data.F.

◆ g14_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a5 = 0.2884320_dp

Definition at line 148 of file qmmm_gaussian_data.F.

◆ g14_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b5 = 1.023350_dp

Definition at line 148 of file qmmm_gaussian_data.F.

◆ g14_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a6 = 0.2186240_dp

Definition at line 149 of file qmmm_gaussian_data.F.

◆ g14_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b6 = 1.326440_dp

Definition at line 149 of file qmmm_gaussian_data.F.

◆ g14_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a7 = 0.0700271_dp

Definition at line 150 of file qmmm_gaussian_data.F.

◆ g14_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b7 = 3.483220_dp

Definition at line 150 of file qmmm_gaussian_data.F.

◆ g14_a8

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a8 = 0.1656890_dp

Definition at line 151 of file qmmm_gaussian_data.F.

◆ g14_b8

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b8 = 1.710300_dp

Definition at line 151 of file qmmm_gaussian_data.F.

◆ g14_a9

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a9 = 0.0493301_dp

Definition at line 152 of file qmmm_gaussian_data.F.

◆ g14_b9

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b9 = 4.268870_dp

Definition at line 152 of file qmmm_gaussian_data.F.

◆ g14_a10

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a10 = 0.1254840_dp

Definition at line 153 of file qmmm_gaussian_data.F.

◆ g14_b10

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b10 = 2.190730_dp

Definition at line 153 of file qmmm_gaussian_data.F.

◆ g14_a11

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a11 = 0.0303071_dp

Definition at line 154 of file qmmm_gaussian_data.F.

◆ g14_b11

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b11 = 4.999930_dp

Definition at line 154 of file qmmm_gaussian_data.F.

◆ g14_a12

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a12 = 0.5269670_dp

Definition at line 155 of file qmmm_gaussian_data.F.

◆ g14_b12

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b12 = 0.475269_dp

Definition at line 155 of file qmmm_gaussian_data.F.

◆ g14_a13

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a13 = 0.3496170_dp

Definition at line 156 of file qmmm_gaussian_data.F.

◆ g14_b13

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b13 = 0.397232_dp

Definition at line 156 of file qmmm_gaussian_data.F.

◆ g14_a14

real(kind=dp), parameter, public qmmm_gaussian_data::g14_a14 = 0.4776640_dp

Definition at line 157 of file qmmm_gaussian_data.F.

◆ g14_b14

real(kind=dp), parameter, public qmmm_gaussian_data::g14_b14 = 0.605916_dp

Definition at line 157 of file qmmm_gaussian_data.F.

◆ g15_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g15_rc = 0.10_dp

Definition at line 159 of file qmmm_gaussian_data.F.

◆ g15_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a1 = 1.3606800_dp

Definition at line 160 of file qmmm_gaussian_data.F.

◆ g15_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b1 = 0.310940_dp

Definition at line 160 of file qmmm_gaussian_data.F.

◆ g15_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a2 = 0.0266233_dp

Definition at line 161 of file qmmm_gaussian_data.F.

◆ g15_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b2 = 5.801190_dp

Definition at line 161 of file qmmm_gaussian_data.F.

◆ g15_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a3 = 0.3896280_dp

Definition at line 162 of file qmmm_gaussian_data.F.

◆ g15_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b3 = 0.813967_dp

Definition at line 162 of file qmmm_gaussian_data.F.

◆ g15_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a4 = 0.0155094_dp

Definition at line 163 of file qmmm_gaussian_data.F.

◆ g15_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b4 = 5.800280_dp

Definition at line 163 of file qmmm_gaussian_data.F.

◆ g15_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a5 = 0.5574040_dp

Definition at line 164 of file qmmm_gaussian_data.F.

◆ g15_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b5 = 0.609044_dp

Definition at line 164 of file qmmm_gaussian_data.F.

◆ g15_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a6 = 0.8507370_dp

Definition at line 165 of file qmmm_gaussian_data.F.

◆ g15_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b6 = 0.443840_dp

Definition at line 165 of file qmmm_gaussian_data.F.

◆ g15_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a7 = 0.1590220_dp

Definition at line 166 of file qmmm_gaussian_data.F.

◆ g15_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b7 = 1.808170_dp

Definition at line 166 of file qmmm_gaussian_data.F.

◆ g15_a8

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a8 = 0.2837530_dp

Definition at line 167 of file qmmm_gaussian_data.F.

◆ g15_b8

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b8 = 1.071380_dp

Definition at line 167 of file qmmm_gaussian_data.F.

◆ g15_a9

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a9 = 0.0645391_dp

Definition at line 168 of file qmmm_gaussian_data.F.

◆ g15_b9

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b9 = 3.723390_dp

Definition at line 168 of file qmmm_gaussian_data.F.

◆ g15_a10

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a10 = 0.0241980_dp

Definition at line 169 of file qmmm_gaussian_data.F.

◆ g15_b10

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b10 = 4.946500_dp

Definition at line 169 of file qmmm_gaussian_data.F.

◆ g15_a11

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a11 = 0.0344342_dp

Definition at line 170 of file qmmm_gaussian_data.F.

◆ g15_b11

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b11 = 4.462030_dp

Definition at line 170 of file qmmm_gaussian_data.F.

◆ g15_a12

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a12 = 0.2112170_dp

Definition at line 171 of file qmmm_gaussian_data.F.

◆ g15_b12

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b12 = 1.396840_dp

Definition at line 171 of file qmmm_gaussian_data.F.

◆ g15_a13

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a13 = 0.1202950_dp

Definition at line 172 of file qmmm_gaussian_data.F.

◆ g15_b13

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b13 = 2.325120_dp

Definition at line 172 of file qmmm_gaussian_data.F.

◆ g15_a14

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a14 = 0.0904425_dp

Definition at line 173 of file qmmm_gaussian_data.F.

◆ g15_b14

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b14 = 2.965550_dp

Definition at line 173 of file qmmm_gaussian_data.F.

◆ g15_a15

real(kind=dp), parameter, public qmmm_gaussian_data::g15_a15 = 1.6040000_dp

Definition at line 174 of file qmmm_gaussian_data.F.

◆ g15_b15

real(kind=dp), parameter, public qmmm_gaussian_data::g15_b15 = 0.216434_dp

Definition at line 174 of file qmmm_gaussian_data.F.

◆ g16_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g16_rc = 0.10_dp

Definition at line 176 of file qmmm_gaussian_data.F.

◆ g16_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a1 = 1.5843100_dp

Definition at line 177 of file qmmm_gaussian_data.F.

◆ g16_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b1 = 0.215959_dp

Definition at line 177 of file qmmm_gaussian_data.F.

◆ g16_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a2 = 0.0253725_dp

Definition at line 178 of file qmmm_gaussian_data.F.

◆ g16_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b2 = 5.737070_dp

Definition at line 178 of file qmmm_gaussian_data.F.

◆ g16_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a3 = 0.1191710_dp

Definition at line 179 of file qmmm_gaussian_data.F.

◆ g16_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b3 = 2.233620_dp

Definition at line 179 of file qmmm_gaussian_data.F.

◆ g16_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a4 = 0.2848860_dp

Definition at line 180 of file qmmm_gaussian_data.F.

◆ g16_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b4 = 1.050490_dp

Definition at line 180 of file qmmm_gaussian_data.F.

◆ g16_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a5 = 0.0134257_dp

Definition at line 181 of file qmmm_gaussian_data.F.

◆ g16_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b5 = 5.720440_dp

Definition at line 181 of file qmmm_gaussian_data.F.

◆ g16_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a6 = 0.0269327_dp

Definition at line 182 of file qmmm_gaussian_data.F.

◆ g16_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b6 = 4.542090_dp

Definition at line 182 of file qmmm_gaussian_data.F.

◆ g16_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a7 = 0.0888076_dp

Definition at line 183 of file qmmm_gaussian_data.F.

◆ g16_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b7 = 2.807370_dp

Definition at line 183 of file qmmm_gaussian_data.F.

◆ g16_a8

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a8 = 0.3907140_dp

Definition at line 184 of file qmmm_gaussian_data.F.

◆ g16_b8

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b8 = 0.801210_dp

Definition at line 184 of file qmmm_gaussian_data.F.

◆ g16_a9

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a9 = 0.5584020_dp

Definition at line 185 of file qmmm_gaussian_data.F.

◆ g16_b9

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b9 = 0.601540_dp

Definition at line 185 of file qmmm_gaussian_data.F.

◆ g16_a10

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a10 = 0.0674428_dp

Definition at line 186 of file qmmm_gaussian_data.F.

◆ g16_b10

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b10 = 3.477020_dp

Definition at line 186 of file qmmm_gaussian_data.F.

◆ g16_a11

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a11 = 0.0167448_dp

Definition at line 187 of file qmmm_gaussian_data.F.

◆ g16_b11

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b11 = 5.320770_dp

Definition at line 187 of file qmmm_gaussian_data.F.

◆ g16_a12

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a12 = 0.2120830_dp

Definition at line 188 of file qmmm_gaussian_data.F.

◆ g16_b12

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b12 = 1.363230_dp

Definition at line 188 of file qmmm_gaussian_data.F.

◆ g16_a13

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a13 = 0.0363796_dp

Definition at line 189 of file qmmm_gaussian_data.F.

◆ g16_b13

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b13 = 4.204950_dp

Definition at line 189 of file qmmm_gaussian_data.F.

◆ g16_a14

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a14 = 0.8512990_dp

Definition at line 190 of file qmmm_gaussian_data.F.

◆ g16_b14

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b14 = 0.439692_dp

Definition at line 190 of file qmmm_gaussian_data.F.

◆ g16_a15

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a15 = 0.1591170_dp

Definition at line 191 of file qmmm_gaussian_data.F.

◆ g16_b15

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b15 = 1.753690_dp

Definition at line 191 of file qmmm_gaussian_data.F.

◆ g16_a16

real(kind=dp), parameter, public qmmm_gaussian_data::g16_a16 = 1.3566500_dp

Definition at line 192 of file qmmm_gaussian_data.F.

◆ g16_b16

real(kind=dp), parameter, public qmmm_gaussian_data::g16_b16 = 0.308985_dp

Definition at line 192 of file qmmm_gaussian_data.F.

◆ g17_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g17_rc = 0.10_dp

Definition at line 194 of file qmmm_gaussian_data.F.

◆ g17_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a1 = 0.0286263_dp

Definition at line 195 of file qmmm_gaussian_data.F.

◆ g17_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b1 = 5.897570_dp

Definition at line 195 of file qmmm_gaussian_data.F.

◆ g17_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a2 = 1.3621700_dp

Definition at line 196 of file qmmm_gaussian_data.F.

◆ g17_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b2 = 0.210930_dp

Definition at line 196 of file qmmm_gaussian_data.F.

◆ g17_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a3 = 0.8582340_dp

Definition at line 197 of file qmmm_gaussian_data.F.

◆ g17_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b3 = 0.396804_dp

Definition at line 197 of file qmmm_gaussian_data.F.

◆ g17_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a4 = 0.0918589_dp

Definition at line 198 of file qmmm_gaussian_data.F.

◆ g17_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b4 = 2.514930_dp

Definition at line 198 of file qmmm_gaussian_data.F.

◆ g17_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a5 = 0.2314390_dp

Definition at line 199 of file qmmm_gaussian_data.F.

◆ g17_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b5 = 1.077620_dp

Definition at line 199 of file qmmm_gaussian_data.F.

◆ g17_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a6 = 1.3030900_dp

Definition at line 200 of file qmmm_gaussian_data.F.

◆ g17_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b6 = 0.288252_dp

Definition at line 200 of file qmmm_gaussian_data.F.

◆ g17_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a7 = 0.1437920_dp

Definition at line 201 of file qmmm_gaussian_data.F.

◆ g17_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b7 = 1.658970_dp

Definition at line 201 of file qmmm_gaussian_data.F.

◆ g17_a8

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a8 = 0.3010060_dp

Definition at line 202 of file qmmm_gaussian_data.F.

◆ g17_b8

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b8 = 0.860535_dp

Definition at line 202 of file qmmm_gaussian_data.F.

◆ g17_a9

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a9 = 0.0274321_dp

Definition at line 203 of file qmmm_gaussian_data.F.

◆ g17_b9

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b9 = 5.099500_dp

Definition at line 203 of file qmmm_gaussian_data.F.

◆ g17_a10

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a10 = 0.1814220_dp

Definition at line 204 of file qmmm_gaussian_data.F.

◆ g17_b10

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b10 = 1.340220_dp

Definition at line 204 of file qmmm_gaussian_data.F.

◆ g17_a11

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a11 = 0.4046220_dp

Definition at line 205 of file qmmm_gaussian_data.F.

◆ g17_b11

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b11 = 0.679621_dp

Definition at line 205 of file qmmm_gaussian_data.F.

◆ g17_a12

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a12 = 0.0735338_dp

Definition at line 206 of file qmmm_gaussian_data.F.

◆ g17_b12

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b12 = 3.080580_dp

Definition at line 206 of file qmmm_gaussian_data.F.

◆ g17_a13

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a13 = 0.0577419_dp

Definition at line 207 of file qmmm_gaussian_data.F.

◆ g17_b13

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b13 = 3.752150_dp

Definition at line 207 of file qmmm_gaussian_data.F.

◆ g17_a14

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a14 = 0.0388557_dp

Definition at line 208 of file qmmm_gaussian_data.F.

◆ g17_b14

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b14 = 4.481620_dp

Definition at line 208 of file qmmm_gaussian_data.F.

◆ g17_a15

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a15 = 0.1147140_dp

Definition at line 209 of file qmmm_gaussian_data.F.

◆ g17_b15

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b15 = 2.045960_dp

Definition at line 209 of file qmmm_gaussian_data.F.

◆ g17_a16

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a16 = 0.5719720_dp

Definition at line 210 of file qmmm_gaussian_data.F.

◆ g17_b16

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b16 = 0.526925_dp

Definition at line 210 of file qmmm_gaussian_data.F.

◆ g17_a17

real(kind=dp), parameter, public qmmm_gaussian_data::g17_a17 = 0.0222331_dp

Definition at line 211 of file qmmm_gaussian_data.F.

◆ g17_b17

real(kind=dp), parameter, public qmmm_gaussian_data::g17_b17 = 6.674390_dp

Definition at line 211 of file qmmm_gaussian_data.F.

◆ g18_rc

real(kind=dp), parameter, public qmmm_gaussian_data::g18_rc = 0.10_dp

Definition at line 213 of file qmmm_gaussian_data.F.

◆ g18_a1

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a1 = 0.0326473_dp

Definition at line 214 of file qmmm_gaussian_data.F.

◆ g18_b1

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b1 = 5.962800_dp

Definition at line 214 of file qmmm_gaussian_data.F.

◆ g18_a2

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a2 = 0.0181199_dp

Definition at line 215 of file qmmm_gaussian_data.F.

◆ g18_b2

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b2 = 6.674950_dp

Definition at line 215 of file qmmm_gaussian_data.F.

◆ g18_a3

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a3 = 0.8582970_dp

Definition at line 216 of file qmmm_gaussian_data.F.

◆ g18_b3

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b3 = 0.396103_dp

Definition at line 216 of file qmmm_gaussian_data.F.

◆ g18_a4

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a4 = 0.0880221_dp

Definition at line 217 of file qmmm_gaussian_data.F.

◆ g18_b4

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b4 = 2.468750_dp

Definition at line 217 of file qmmm_gaussian_data.F.

◆ g18_a5

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a5 = 0.1812460_dp

Definition at line 218 of file qmmm_gaussian_data.F.

◆ g18_b5

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b5 = 1.332910_dp

Definition at line 218 of file qmmm_gaussian_data.F.

◆ g18_a6

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a6 = 0.2314380_dp

Definition at line 219 of file qmmm_gaussian_data.F.

◆ g18_b6

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b6 = 1.072960_dp

Definition at line 219 of file qmmm_gaussian_data.F.

◆ g18_a7

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a7 = 0.0449632_dp

Definition at line 220 of file qmmm_gaussian_data.F.

◆ g18_b7

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b7 = 3.435210_dp

Definition at line 220 of file qmmm_gaussian_data.F.

◆ g18_a8

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a8 = 1.3583000_dp

Definition at line 221 of file qmmm_gaussian_data.F.

◆ g18_b8

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b8 = 0.210847_dp

Definition at line 221 of file qmmm_gaussian_data.F.

◆ g18_a9

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a9 = 0.1132310_dp

Definition at line 222 of file qmmm_gaussian_data.F.

◆ g18_b9

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b9 = 2.024200_dp

Definition at line 222 of file qmmm_gaussian_data.F.

◆ g18_a10

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a10 = 0.0251085_dp

Definition at line 223 of file qmmm_gaussian_data.F.

◆ g18_b10

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b10 = 4.226690_dp

Definition at line 223 of file qmmm_gaussian_data.F.

◆ g18_a11

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a11 = 0.4047630_dp

Definition at line 224 of file qmmm_gaussian_data.F.

◆ g18_b11

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b11 = 0.677704_dp

Definition at line 224 of file qmmm_gaussian_data.F.

◆ g18_a12

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a12 = 0.3010870_dp

Definition at line 225 of file qmmm_gaussian_data.F.

◆ g18_b12

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b12 = 0.857535_dp

Definition at line 225 of file qmmm_gaussian_data.F.

◆ g18_a13

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a13 = 1.3019600_dp

Definition at line 226 of file qmmm_gaussian_data.F.

◆ g18_b13

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b13 = 0.287909_dp

Definition at line 226 of file qmmm_gaussian_data.F.

◆ g18_a14

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a14 = 0.1432190_dp

Definition at line 227 of file qmmm_gaussian_data.F.

◆ g18_b14

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b14 = 1.646940_dp

Definition at line 227 of file qmmm_gaussian_data.F.

◆ g18_a15

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a15 = 0.0634725_dp

Definition at line 228 of file qmmm_gaussian_data.F.

◆ g18_b15

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b15 = 2.959960_dp

Definition at line 228 of file qmmm_gaussian_data.F.

◆ g18_a16

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a16 = 0.5721690_dp

Definition at line 229 of file qmmm_gaussian_data.F.

◆ g18_b16

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b16 = 0.525730_dp

Definition at line 229 of file qmmm_gaussian_data.F.

◆ g18_a17

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a17 = 0.0309731_dp

Definition at line 230 of file qmmm_gaussian_data.F.

◆ g18_b17

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b17 = 3.918400_dp

Definition at line 230 of file qmmm_gaussian_data.F.

◆ g18_a18

real(kind=dp), parameter, public qmmm_gaussian_data::g18_a18 = 0.0429091_dp

Definition at line 231 of file qmmm_gaussian_data.F.

◆ g18_b18

real(kind=dp), parameter, public qmmm_gaussian_data::g18_b18 = 4.928750_dp

Definition at line 231 of file qmmm_gaussian_data.F.

◆ s2_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s2_rc = 1.2_dp

Definition at line 235 of file qmmm_gaussian_data.F.

◆ s2_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s2_a1 = 0.1167720_dp

Definition at line 236 of file qmmm_gaussian_data.F.

◆ s2_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s2_b1 = 3.15760_dp

Definition at line 236 of file qmmm_gaussian_data.F.

◆ s2_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s2_a2 = 0.0537459_dp

Definition at line 237 of file qmmm_gaussian_data.F.

◆ s2_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s2_b2 = 1.66713_dp

Definition at line 237 of file qmmm_gaussian_data.F.

◆ s3_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s3_rc = 1.05_dp

Definition at line 239 of file qmmm_gaussian_data.F.

◆ s3_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s3_a1 = 0.1258370_dp

Definition at line 240 of file qmmm_gaussian_data.F.

◆ s3_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s3_b1 = 3.54518_dp

Definition at line 240 of file qmmm_gaussian_data.F.

◆ s3_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s3_a2 = 0.0920562_dp

Definition at line 241 of file qmmm_gaussian_data.F.

◆ s3_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s3_b2 = 2.17201_dp

Definition at line 241 of file qmmm_gaussian_data.F.

◆ s3_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s3_a3 = 0.0354098_dp

Definition at line 242 of file qmmm_gaussian_data.F.

◆ s3_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s3_b3 = 1.16797_dp

Definition at line 242 of file qmmm_gaussian_data.F.

◆ s4_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s4_rc = 0.90_dp

Definition at line 244 of file qmmm_gaussian_data.F.

◆ s4_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s4_a1 = 0.1237040_dp

Definition at line 245 of file qmmm_gaussian_data.F.

◆ s4_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s4_b1 = 3.82356_dp

Definition at line 245 of file qmmm_gaussian_data.F.

◆ s4_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s4_a2 = 0.0263957_dp

Definition at line 246 of file qmmm_gaussian_data.F.

◆ s4_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s4_b2 = 0.84445_dp

Definition at line 246 of file qmmm_gaussian_data.F.

◆ s4_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s4_a3 = 0.0773548_dp

Definition at line 247 of file qmmm_gaussian_data.F.

◆ s4_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s4_b3 = 1.56300_dp

Definition at line 247 of file qmmm_gaussian_data.F.

◆ s4_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s4_a4 = 0.1243300_dp

Definition at line 248 of file qmmm_gaussian_data.F.

◆ s4_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s4_b4 = 2.49568_dp

Definition at line 248 of file qmmm_gaussian_data.F.

◆ s5_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s5_rc = 0.80_dp

Definition at line 250 of file qmmm_gaussian_data.F.

◆ s5_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s5_a1 = 0.0601509_dp

Definition at line 251 of file qmmm_gaussian_data.F.

◆ s5_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s5_b1 = 1.169940_dp

Definition at line 251 of file qmmm_gaussian_data.F.

◆ s5_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s5_a2 = 0.1133640_dp

Definition at line 252 of file qmmm_gaussian_data.F.

◆ s5_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s5_b2 = 1.853660_dp

Definition at line 252 of file qmmm_gaussian_data.F.

◆ s5_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s5_a3 = 0.1120710_dp

Definition at line 253 of file qmmm_gaussian_data.F.

◆ s5_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s5_b3 = 4.084220_dp

Definition at line 253 of file qmmm_gaussian_data.F.

◆ s5_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s5_a4 = 0.1334100_dp

Definition at line 254 of file qmmm_gaussian_data.F.

◆ s5_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s5_b4 = 2.762410_dp

Definition at line 254 of file qmmm_gaussian_data.F.

◆ s5_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s5_a5 = 0.0186655_dp

Definition at line 255 of file qmmm_gaussian_data.F.

◆ s5_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s5_b5 = 0.633305_dp

Definition at line 255 of file qmmm_gaussian_data.F.

◆ s6_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s6_rc = 0.70_dp

Definition at line 257 of file qmmm_gaussian_data.F.

◆ s6_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s6_a1 = 0.0494163_dp

Definition at line 258 of file qmmm_gaussian_data.F.

◆ s6_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s6_b1 = 0.889897_dp

Definition at line 258 of file qmmm_gaussian_data.F.

◆ s6_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s6_a2 = 0.1415590_dp

Definition at line 259 of file qmmm_gaussian_data.F.

◆ s6_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s6_b2 = 2.073620_dp

Definition at line 259 of file qmmm_gaussian_data.F.

◆ s6_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s6_a3 = 0.1311110_dp

Definition at line 260 of file qmmm_gaussian_data.F.

◆ s6_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s6_b3 = 2.977960_dp

Definition at line 260 of file qmmm_gaussian_data.F.

◆ s6_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s6_a4 = 0.1012530_dp

Definition at line 261 of file qmmm_gaussian_data.F.

◆ s6_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s6_b4 = 4.306440_dp

Definition at line 261 of file qmmm_gaussian_data.F.

◆ s6_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s6_a5 = 0.1037040_dp

Definition at line 262 of file qmmm_gaussian_data.F.

◆ s6_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s6_b5 = 1.405500_dp

Definition at line 262 of file qmmm_gaussian_data.F.

◆ s6_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s6_a6 = 0.0144409_dp

Definition at line 263 of file qmmm_gaussian_data.F.

◆ s6_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s6_b6 = 0.482098_dp

Definition at line 263 of file qmmm_gaussian_data.F.

◆ s7_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s7_rc = 0.65_dp

Definition at line 265 of file qmmm_gaussian_data.F.

◆ s7_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s7_a1 = 0.08156290_dp

Definition at line 266 of file qmmm_gaussian_data.F.

◆ s7_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s7_b1 = 1.104000_dp

Definition at line 266 of file qmmm_gaussian_data.F.

◆ s7_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s7_a2 = 0.00971659_dp

Definition at line 267 of file qmmm_gaussian_data.F.

◆ s7_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s7_b2 = 0.379602_dp

Definition at line 267 of file qmmm_gaussian_data.F.

◆ s7_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s7_a3 = 0.09067690_dp

Definition at line 268 of file qmmm_gaussian_data.F.

◆ s7_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s7_b3 = 4.537130_dp

Definition at line 268 of file qmmm_gaussian_data.F.

◆ s7_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s7_a4 = 0.14334400_dp

Definition at line 269 of file qmmm_gaussian_data.F.

◆ s7_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s7_b4 = 2.290480_dp

Definition at line 269 of file qmmm_gaussian_data.F.

◆ s7_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s7_a5 = 0.13012600_dp

Definition at line 270 of file qmmm_gaussian_data.F.

◆ s7_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s7_b5 = 1.619190_dp

Definition at line 270 of file qmmm_gaussian_data.F.

◆ s7_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s7_a6 = 0.11794100_dp

Definition at line 271 of file qmmm_gaussian_data.F.

◆ s7_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s7_b6 = 3.205850_dp

Definition at line 271 of file qmmm_gaussian_data.F.

◆ s7_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s7_a7 = 0.03510960_dp

Definition at line 272 of file qmmm_gaussian_data.F.

◆ s7_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s7_b7 = 0.700361_dp

Definition at line 272 of file qmmm_gaussian_data.F.

◆ s8_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s8_rc = 0.60_dp

Definition at line 274 of file qmmm_gaussian_data.F.

◆ s8_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s8_a1 = 0.14676300_dp

Definition at line 275 of file qmmm_gaussian_data.F.

◆ s8_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s8_b1 = 1.802170_dp

Definition at line 275 of file qmmm_gaussian_data.F.

◆ s8_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s8_a2 = 0.00686211_dp

Definition at line 276 of file qmmm_gaussian_data.F.

◆ s8_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s8_b2 = 0.302201_dp

Definition at line 276 of file qmmm_gaussian_data.F.

◆ s8_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s8_a3 = 0.08248590_dp

Definition at line 277 of file qmmm_gaussian_data.F.

◆ s8_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s8_b3 = 4.741690_dp

Definition at line 277 of file qmmm_gaussian_data.F.

◆ s8_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s8_a4 = 0.10588700_dp

Definition at line 278 of file qmmm_gaussian_data.F.

◆ s8_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s8_b4 = 3.410740_dp

Definition at line 278 of file qmmm_gaussian_data.F.

◆ s8_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s8_a5 = 0.06409090_dp

Definition at line 279 of file qmmm_gaussian_data.F.

◆ s8_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s8_b5 = 0.877859_dp

Definition at line 279 of file qmmm_gaussian_data.F.

◆ s8_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s8_a6 = 0.11461200_dp

Definition at line 280 of file qmmm_gaussian_data.F.

◆ s8_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s8_b6 = 1.283730_dp

Definition at line 280 of file qmmm_gaussian_data.F.

◆ s8_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s8_a7 = 0.13708200_dp

Definition at line 281 of file qmmm_gaussian_data.F.

◆ s8_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s8_b7 = 2.482170_dp

Definition at line 281 of file qmmm_gaussian_data.F.

◆ s8_a8

real(kind=dp), parameter, public qmmm_gaussian_data::s8_a8 = 0.02571900_dp

Definition at line 282 of file qmmm_gaussian_data.F.

◆ s8_b8

real(kind=dp), parameter, public qmmm_gaussian_data::s8_b8 = 0.557431_dp

Definition at line 282 of file qmmm_gaussian_data.F.

◆ s9_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s9_rc = 0.55_dp

Definition at line 284 of file qmmm_gaussian_data.F.

◆ s9_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s9_a1 = 0.0760147_dp

Definition at line 285 of file qmmm_gaussian_data.F.

◆ s9_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s9_b1 = 4.924130_dp

Definition at line 285 of file qmmm_gaussian_data.F.

◆ s9_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s9_a2 = 0.0050867_dp

Definition at line 286 of file qmmm_gaussian_data.F.

◆ s9_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s9_b2 = 0.242656_dp

Definition at line 286 of file qmmm_gaussian_data.F.

◆ s9_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s9_a3 = 0.1524530_dp

Definition at line 287 of file qmmm_gaussian_data.F.

◆ s9_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s9_b3 = 1.962780_dp

Definition at line 287 of file qmmm_gaussian_data.F.

◆ s9_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s9_a4 = 0.0993944_dp

Definition at line 288 of file qmmm_gaussian_data.F.

◆ s9_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s9_b4 = 1.028540_dp

Definition at line 288 of file qmmm_gaussian_data.F.

◆ s9_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s9_a5 = 0.1433380_dp

Definition at line 289 of file qmmm_gaussian_data.F.

◆ s9_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s9_b5 = 1.438020_dp

Definition at line 289 of file qmmm_gaussian_data.F.

◆ s9_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s9_a6 = 0.1267950_dp

Definition at line 290 of file qmmm_gaussian_data.F.

◆ s9_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s9_b6 = 2.655630_dp

Definition at line 290 of file qmmm_gaussian_data.F.

◆ s9_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s9_a7 = 0.0958376_dp

Definition at line 291 of file qmmm_gaussian_data.F.

◆ s9_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s9_b7 = 3.595590_dp

Definition at line 291 of file qmmm_gaussian_data.F.

◆ s9_a8

real(kind=dp), parameter, public qmmm_gaussian_data::s9_a8 = 0.0511698_dp

Definition at line 292 of file qmmm_gaussian_data.F.

◆ s9_b8

real(kind=dp), parameter, public qmmm_gaussian_data::s9_b8 = 0.704455_dp

Definition at line 292 of file qmmm_gaussian_data.F.

◆ s9_a9

real(kind=dp), parameter, public qmmm_gaussian_data::s9_a9 = 0.0195500_dp

Definition at line 293 of file qmmm_gaussian_data.F.

◆ s9_b9

real(kind=dp), parameter, public qmmm_gaussian_data::s9_b9 = 0.447544_dp

Definition at line 293 of file qmmm_gaussian_data.F.

◆ s10_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s10_rc = 0.5_dp

Definition at line 295 of file qmmm_gaussian_data.F.

◆ s10_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s10_a1 = 0.11585200_dp

Definition at line 296 of file qmmm_gaussian_data.F.

◆ s10_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s10_b1 = 2.814420_dp

Definition at line 296 of file qmmm_gaussian_data.F.

◆ s10_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s10_a2 = 0.01551000_dp

Definition at line 297 of file qmmm_gaussian_data.F.

◆ s10_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s10_b2 = 0.361841_dp

Definition at line 297 of file qmmm_gaussian_data.F.

◆ s10_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s10_a3 = 0.08772520_dp

Definition at line 298 of file qmmm_gaussian_data.F.

◆ s10_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s10_b3 = 3.762340_dp

Definition at line 298 of file qmmm_gaussian_data.F.

◆ s10_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s10_a4 = 0.16279600_dp

Definition at line 299 of file qmmm_gaussian_data.F.

◆ s10_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s10_b4 = 1.572690_dp

Definition at line 299 of file qmmm_gaussian_data.F.

◆ s10_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s10_a5 = 0.08664120_dp

Definition at line 300 of file qmmm_gaussian_data.F.

◆ s10_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s10_b5 = 0.830482_dp

Definition at line 300 of file qmmm_gaussian_data.F.

◆ s10_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s10_a6 = 0.13675500_dp

Definition at line 301 of file qmmm_gaussian_data.F.

◆ s10_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s10_b6 = 1.158370_dp

Definition at line 301 of file qmmm_gaussian_data.F.

◆ s10_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s10_a7 = 0.04201910_dp

Definition at line 302 of file qmmm_gaussian_data.F.

◆ s10_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s10_b7 = 0.569340_dp

Definition at line 302 of file qmmm_gaussian_data.F.

◆ s10_a8

real(kind=dp), parameter, public qmmm_gaussian_data::s10_a8 = 0.14880800_dp

Definition at line 303 of file qmmm_gaussian_data.F.

◆ s10_b8

real(kind=dp), parameter, public qmmm_gaussian_data::s10_b8 = 2.107180_dp

Definition at line 303 of file qmmm_gaussian_data.F.

◆ s10_a9

real(kind=dp), parameter, public qmmm_gaussian_data::s10_a9 = 0.07080240_dp

Definition at line 304 of file qmmm_gaussian_data.F.

◆ s10_b9

real(kind=dp), parameter, public qmmm_gaussian_data::s10_b9 = 5.087590_dp

Definition at line 304 of file qmmm_gaussian_data.F.

◆ s10_a10

real(kind=dp), parameter, public qmmm_gaussian_data::s10_a10 = 0.00396733_dp

Definition at line 305 of file qmmm_gaussian_data.F.

◆ s10_b10

real(kind=dp), parameter, public qmmm_gaussian_data::s10_b10 = 0.196230_dp

Definition at line 305 of file qmmm_gaussian_data.F.

◆ s11_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s11_rc = 0.45_dp

Definition at line 307 of file qmmm_gaussian_data.F.

◆ s11_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s11_a1 = 0.16967500_dp

Definition at line 308 of file qmmm_gaussian_data.F.

◆ s11_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s11_b1 = 1.274890_dp

Definition at line 308 of file qmmm_gaussian_data.F.

◆ s11_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s11_a2 = 0.01316070_dp

Definition at line 309 of file qmmm_gaussian_data.F.

◆ s11_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s11_b2 = 0.296680_dp

Definition at line 309 of file qmmm_gaussian_data.F.

◆ s11_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s11_a3 = 0.06640200_dp

Definition at line 310 of file qmmm_gaussian_data.F.

◆ s11_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s11_b3 = 5.239300_dp

Definition at line 310 of file qmmm_gaussian_data.F.

◆ s11_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s11_a4 = 0.10578100_dp

Definition at line 311 of file qmmm_gaussian_data.F.

◆ s11_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s11_b4 = 2.964600_dp

Definition at line 311 of file qmmm_gaussian_data.F.

◆ s11_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s11_a5 = 0.07769660_dp

Definition at line 312 of file qmmm_gaussian_data.F.

◆ s11_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s11_b5 = 0.677602_dp

Definition at line 312 of file qmmm_gaussian_data.F.

◆ s11_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s11_a6 = 0.08097080_dp

Definition at line 313 of file qmmm_gaussian_data.F.

◆ s11_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s11_b6 = 3.917730_dp

Definition at line 313 of file qmmm_gaussian_data.F.

◆ s11_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s11_a7 = 0.16973700_dp

Definition at line 314 of file qmmm_gaussian_data.F.

◆ s11_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s11_b7 = 1.696540_dp

Definition at line 314 of file qmmm_gaussian_data.F.

◆ s11_a8

real(kind=dp), parameter, public qmmm_gaussian_data::s11_a8 = 0.13064000_dp

Definition at line 315 of file qmmm_gaussian_data.F.

◆ s11_b8

real(kind=dp), parameter, public qmmm_gaussian_data::s11_b8 = 0.942777_dp

Definition at line 315 of file qmmm_gaussian_data.F.

◆ s11_a9

real(kind=dp), parameter, public qmmm_gaussian_data::s11_a9 = 0.03627480_dp

Definition at line 316 of file qmmm_gaussian_data.F.

◆ s11_b9

real(kind=dp), parameter, public qmmm_gaussian_data::s11_b9 = 0.465541_dp

Definition at line 316 of file qmmm_gaussian_data.F.

◆ s11_a10

real(kind=dp), parameter, public qmmm_gaussian_data::s11_a10 = 0.13917200_dp

Definition at line 317 of file qmmm_gaussian_data.F.

◆ s11_b10

real(kind=dp), parameter, public qmmm_gaussian_data::s11_b10 = 2.244230_dp

Definition at line 317 of file qmmm_gaussian_data.F.

◆ s11_a11

real(kind=dp), parameter, public qmmm_gaussian_data::s11_a11 = 0.00336822_dp

Definition at line 318 of file qmmm_gaussian_data.F.

◆ s11_b11

real(kind=dp), parameter, public qmmm_gaussian_data::s11_b11 = 0.161548_dp

Definition at line 318 of file qmmm_gaussian_data.F.

◆ s12_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s12_rc = 0.40_dp

Definition at line 320 of file qmmm_gaussian_data.F.

◆ s12_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a1 = 0.09642700_dp

Definition at line 321 of file qmmm_gaussian_data.F.

◆ s12_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b1 = 3.118890_dp

Definition at line 321 of file qmmm_gaussian_data.F.

◆ s12_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a2 = 0.17691800_dp

Definition at line 322 of file qmmm_gaussian_data.F.

◆ s12_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b2 = 1.052170_dp

Definition at line 322 of file qmmm_gaussian_data.F.

◆ s12_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a3 = 0.06232170_dp

Definition at line 323 of file qmmm_gaussian_data.F.

◆ s12_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b3 = 5.393160_dp

Definition at line 323 of file qmmm_gaussian_data.F.

◆ s12_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a4 = 0.01269890_dp

Definition at line 324 of file qmmm_gaussian_data.F.

◆ s12_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b4 = 0.252183_dp

Definition at line 324 of file qmmm_gaussian_data.F.

◆ s12_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a5 = 0.07481830_dp

Definition at line 325 of file qmmm_gaussian_data.F.

◆ s12_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b5 = 4.075740_dp

Definition at line 325 of file qmmm_gaussian_data.F.

◆ s12_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a6 = 0.12917000_dp

Definition at line 326 of file qmmm_gaussian_data.F.

◆ s12_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b6 = 0.782380_dp

Definition at line 326 of file qmmm_gaussian_data.F.

◆ s12_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a7 = 0.03450160_dp

Definition at line 327 of file qmmm_gaussian_data.F.

◆ s12_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b7 = 0.391473_dp

Definition at line 327 of file qmmm_gaussian_data.F.

◆ s12_a8

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a8 = 0.12664700_dp

Definition at line 328 of file qmmm_gaussian_data.F.

◆ s12_b8

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b8 = 2.387640_dp

Definition at line 328 of file qmmm_gaussian_data.F.

◆ s12_a9

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a9 = 0.07450870_dp

Definition at line 329 of file qmmm_gaussian_data.F.

◆ s12_b9

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b9 = 0.565577_dp

Definition at line 329 of file qmmm_gaussian_data.F.

◆ s12_a10

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a10 = 0.18916800_dp

Definition at line 330 of file qmmm_gaussian_data.F.

◆ s12_b10

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b10 = 1.390920_dp

Definition at line 330 of file qmmm_gaussian_data.F.

◆ s12_a11

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a11 = 0.16350600_dp

Definition at line 331 of file qmmm_gaussian_data.F.

◆ s12_b11

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b11 = 1.824470_dp

Definition at line 331 of file qmmm_gaussian_data.F.

◆ s12_a12

real(kind=dp), parameter, public qmmm_gaussian_data::s12_a12 = 0.00339586_dp

Definition at line 332 of file qmmm_gaussian_data.F.

◆ s12_b12

real(kind=dp), parameter, public qmmm_gaussian_data::s12_b12 = 0.139492_dp

Definition at line 332 of file qmmm_gaussian_data.F.

◆ s13_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s13_rc = 0.35_dp

Definition at line 334 of file qmmm_gaussian_data.F.

◆ s13_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a1 = 0.0827110_dp

Definition at line 335 of file qmmm_gaussian_data.F.

◆ s13_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b1 = 3.406540_dp

Definition at line 335 of file qmmm_gaussian_data.F.

◆ s13_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a2 = 0.1088730_dp

Definition at line 336 of file qmmm_gaussian_data.F.

◆ s13_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b2 = 2.646630_dp

Definition at line 336 of file qmmm_gaussian_data.F.

◆ s13_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a3 = 0.0548105_dp

Definition at line 337 of file qmmm_gaussian_data.F.

◆ s13_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b3 = 5.651890_dp

Definition at line 337 of file qmmm_gaussian_data.F.

◆ s13_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a4 = 0.1851320_dp

Definition at line 338 of file qmmm_gaussian_data.F.

◆ s13_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b4 = 1.572120_dp

Definition at line 338 of file qmmm_gaussian_data.F.

◆ s13_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a5 = 0.0153281_dp

Definition at line 339 of file qmmm_gaussian_data.F.

◆ s13_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b5 = 0.227432_dp

Definition at line 339 of file qmmm_gaussian_data.F.

◆ s13_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a6 = 0.1447980_dp

Definition at line 340 of file qmmm_gaussian_data.F.

◆ s13_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b6 = 0.684903_dp

Definition at line 340 of file qmmm_gaussian_data.F.

◆ s13_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a7 = 0.0400841_dp

Definition at line 341 of file qmmm_gaussian_data.F.

◆ s13_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b7 = 0.348420_dp

Definition at line 341 of file qmmm_gaussian_data.F.

◆ s13_a8

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a8 = 0.1976780_dp

Definition at line 342 of file qmmm_gaussian_data.F.

◆ s13_b8

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b8 = 0.915974_dp

Definition at line 342 of file qmmm_gaussian_data.F.

◆ s13_a9

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a9 = 0.0845825_dp

Definition at line 343 of file qmmm_gaussian_data.F.

◆ s13_b9

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b9 = 0.498603_dp

Definition at line 343 of file qmmm_gaussian_data.F.

◆ s13_a10

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a10 = 0.2124150_dp

Definition at line 344 of file qmmm_gaussian_data.F.

◆ s13_b10

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b10 = 1.204860_dp

Definition at line 344 of file qmmm_gaussian_data.F.

◆ s13_a11

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a11 = 0.0643854_dp

Definition at line 345 of file qmmm_gaussian_data.F.

◆ s13_b11

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b11 = 4.368000_dp

Definition at line 345 of file qmmm_gaussian_data.F.

◆ s13_a12

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a12 = 0.1438660_dp

Definition at line 346 of file qmmm_gaussian_data.F.

◆ s13_b12

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b12 = 2.044290_dp

Definition at line 346 of file qmmm_gaussian_data.F.

◆ s13_a13

real(kind=dp), parameter, public qmmm_gaussian_data::s13_a13 = 0.0043540_dp

Definition at line 347 of file qmmm_gaussian_data.F.

◆ s13_b13

real(kind=dp), parameter, public qmmm_gaussian_data::s13_b13 = 0.127923_dp

Definition at line 347 of file qmmm_gaussian_data.F.

◆ s14_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s14_rc = 0.3_dp

Definition at line 349 of file qmmm_gaussian_data.F.

◆ s14_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a1 = 0.1185130_dp

Definition at line 350 of file qmmm_gaussian_data.F.

◆ s14_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b1 = 2.483340_dp

Definition at line 350 of file qmmm_gaussian_data.F.

◆ s14_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a2 = 0.2451880_dp

Definition at line 351 of file qmmm_gaussian_data.F.

◆ s14_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b2 = 1.119610_dp

Definition at line 351 of file qmmm_gaussian_data.F.

◆ s14_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a3 = 0.0585112_dp

Definition at line 352 of file qmmm_gaussian_data.F.

◆ s14_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b3 = 0.327881_dp

Definition at line 352 of file qmmm_gaussian_data.F.

◆ s14_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a4 = 0.2441530_dp

Definition at line 353 of file qmmm_gaussian_data.F.

◆ s14_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b4 = 0.851146_dp

Definition at line 353 of file qmmm_gaussian_data.F.

◆ s14_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a5 = 0.1561530_dp

Definition at line 354 of file qmmm_gaussian_data.F.

◆ s14_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b5 = 1.909900_dp

Definition at line 354 of file qmmm_gaussian_data.F.

◆ s14_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a6 = 0.1178640_dp

Definition at line 355 of file qmmm_gaussian_data.F.

◆ s14_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b6 = 0.466300_dp

Definition at line 355 of file qmmm_gaussian_data.F.

◆ s14_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a7 = 0.0710939_dp

Definition at line 356 of file qmmm_gaussian_data.F.

◆ s14_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b7 = 4.176560_dp

Definition at line 356 of file qmmm_gaussian_data.F.

◆ s14_a8

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a8 = 0.0907698_dp

Definition at line 357 of file qmmm_gaussian_data.F.

◆ s14_b8

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b8 = 3.219580_dp

Definition at line 357 of file qmmm_gaussian_data.F.

◆ s14_a9

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a9 = 0.0298147_dp

Definition at line 358 of file qmmm_gaussian_data.F.

◆ s14_b9

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b9 = 5.495980_dp

Definition at line 358 of file qmmm_gaussian_data.F.

◆ s14_a10

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a10 = 0.0233818_dp

Definition at line 359 of file qmmm_gaussian_data.F.

◆ s14_b10

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b10 = 0.215814_dp

Definition at line 359 of file qmmm_gaussian_data.F.

◆ s14_a11

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a11 = 0.2037940_dp

Definition at line 360 of file qmmm_gaussian_data.F.

◆ s14_b11

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b11 = 1.464080_dp

Definition at line 360 of file qmmm_gaussian_data.F.

◆ s14_a12

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a12 = 0.1909540_dp

Definition at line 361 of file qmmm_gaussian_data.F.

◆ s14_b12

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b12 = 0.637845_dp

Definition at line 361 of file qmmm_gaussian_data.F.

◆ s14_a13

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a13 = 0.0300539_dp

Definition at line 362 of file qmmm_gaussian_data.F.

◆ s14_b13

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b13 = 5.481830_dp

Definition at line 362 of file qmmm_gaussian_data.F.

◆ s14_a14

real(kind=dp), parameter, public qmmm_gaussian_data::s14_a14 = 0.0069580_dp

Definition at line 363 of file qmmm_gaussian_data.F.

◆ s14_b14

real(kind=dp), parameter, public qmmm_gaussian_data::s14_b14 = 0.122528_dp

Definition at line 363 of file qmmm_gaussian_data.F.

◆ s15_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s15_rc = 0.25_dp

Definition at line 365 of file qmmm_gaussian_data.F.

◆ s15_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a1 = 0.0945048_dp

Definition at line 366 of file qmmm_gaussian_data.F.

◆ s15_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b1 = 2.945510_dp

Definition at line 366 of file qmmm_gaussian_data.F.

◆ s15_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a2 = 0.2601310_dp

Definition at line 367 of file qmmm_gaussian_data.F.

◆ s15_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b2 = 0.589258_dp

Definition at line 367 of file qmmm_gaussian_data.F.

◆ s15_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a3 = 0.1267470_dp

Definition at line 368 of file qmmm_gaussian_data.F.

◆ s15_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b3 = 2.288550_dp

Definition at line 368 of file qmmm_gaussian_data.F.

◆ s15_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a4 = 0.0389633_dp

Definition at line 369 of file qmmm_gaussian_data.F.

◆ s15_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b4 = 0.203996_dp

Definition at line 369 of file qmmm_gaussian_data.F.

◆ s15_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a5 = 0.1688290_dp

Definition at line 370 of file qmmm_gaussian_data.F.

◆ s15_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b5 = 1.763470_dp

Definition at line 370 of file qmmm_gaussian_data.F.

◆ s15_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a6 = 0.2822050_dp

Definition at line 371 of file qmmm_gaussian_data.F.

◆ s15_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b6 = 1.031520_dp

Definition at line 371 of file qmmm_gaussian_data.F.

◆ s15_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a7 = 0.3048940_dp

Definition at line 372 of file qmmm_gaussian_data.F.

◆ s15_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b7 = 0.784165_dp

Definition at line 372 of file qmmm_gaussian_data.F.

◆ s15_a8

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a8 = 0.0262863_dp

Definition at line 373 of file qmmm_gaussian_data.F.

◆ s15_b8

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b8 = 5.598990_dp

Definition at line 373 of file qmmm_gaussian_data.F.

◆ s15_a9

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a9 = 0.0231427_dp

Definition at line 374 of file qmmm_gaussian_data.F.

◆ s15_b9

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b9 = 5.844390_dp

Definition at line 374 of file qmmm_gaussian_data.F.

◆ s15_a10

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a10 = 0.0484052_dp

Definition at line 375 of file qmmm_gaussian_data.F.

◆ s15_b10

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b10 = 4.606440_dp

Definition at line 375 of file qmmm_gaussian_data.F.

◆ s15_a11

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a11 = 0.0680845_dp

Definition at line 376 of file qmmm_gaussian_data.F.

◆ s15_b11

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b11 = 3.734880_dp

Definition at line 376 of file qmmm_gaussian_data.F.

◆ s15_a12

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a12 = 0.0918188_dp

Definition at line 377 of file qmmm_gaussian_data.F.

◆ s15_b12

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b12 = 0.306903_dp

Definition at line 377 of file qmmm_gaussian_data.F.

◆ s15_a13

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a13 = 0.2236530_dp

Definition at line 378 of file qmmm_gaussian_data.F.

◆ s15_b13

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b13 = 1.351070_dp

Definition at line 378 of file qmmm_gaussian_data.F.

◆ s15_a14

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a14 = 0.1732960_dp

Definition at line 379 of file qmmm_gaussian_data.F.

◆ s15_b14

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b14 = 0.433086_dp

Definition at line 379 of file qmmm_gaussian_data.F.

◆ s15_a15

real(kind=dp), parameter, public qmmm_gaussian_data::s15_a15 = 0.0122787_dp

Definition at line 380 of file qmmm_gaussian_data.F.

◆ s15_b15

real(kind=dp), parameter, public qmmm_gaussian_data::s15_b15 = 0.116976_dp

Definition at line 380 of file qmmm_gaussian_data.F.

◆ s16_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s16_rc = 0.20_dp

Definition at line 382 of file qmmm_gaussian_data.F.

◆ s16_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a1 = 0.0355363_dp

Definition at line 383 of file qmmm_gaussian_data.F.

◆ s16_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b1 = 5.119830_dp

Definition at line 383 of file qmmm_gaussian_data.F.

◆ s16_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a2 = 0.0250461_dp

Definition at line 384 of file qmmm_gaussian_data.F.

◆ s16_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b2 = 0.111228_dp

Definition at line 384 of file qmmm_gaussian_data.F.

◆ s16_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a3 = 0.0555360_dp

Definition at line 385 of file qmmm_gaussian_data.F.

◆ s16_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b3 = 4.232680_dp

Definition at line 385 of file qmmm_gaussian_data.F.

◆ s16_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a4 = 0.0747956_dp

Definition at line 386 of file qmmm_gaussian_data.F.

◆ s16_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b4 = 3.406690_dp

Definition at line 386 of file qmmm_gaussian_data.F.

◆ s16_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a5 = 0.0739676_dp

Definition at line 387 of file qmmm_gaussian_data.F.

◆ s16_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b5 = 0.192075_dp

Definition at line 387 of file qmmm_gaussian_data.F.

◆ s16_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a6 = 0.1016150_dp

Definition at line 388 of file qmmm_gaussian_data.F.

◆ s16_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b6 = 2.694530_dp

Definition at line 388 of file qmmm_gaussian_data.F.

◆ s16_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a7 = 0.1600940_dp

Definition at line 389 of file qmmm_gaussian_data.F.

◆ s16_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b7 = 0.285880_dp

Definition at line 389 of file qmmm_gaussian_data.F.

◆ s16_a8

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a8 = 0.3823200_dp

Definition at line 390 of file qmmm_gaussian_data.F.

◆ s16_b8

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b8 = 0.717807_dp

Definition at line 390 of file qmmm_gaussian_data.F.

◆ s16_a9

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a9 = 0.0174934_dp

Definition at line 391 of file qmmm_gaussian_data.F.

◆ s16_b9

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b9 = 5.965260_dp

Definition at line 391 of file qmmm_gaussian_data.F.

◆ s16_a10

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a10 = 0.1369610_dp

Definition at line 392 of file qmmm_gaussian_data.F.

◆ s16_b10

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b10 = 2.100230_dp

Definition at line 392 of file qmmm_gaussian_data.F.

◆ s16_a11

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a11 = 0.1835200_dp

Definition at line 393 of file qmmm_gaussian_data.F.

◆ s16_b11

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b11 = 1.620280_dp

Definition at line 393 of file qmmm_gaussian_data.F.

◆ s16_a12

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a12 = 0.2453470_dp

Definition at line 394 of file qmmm_gaussian_data.F.

◆ s16_b12

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b12 = 1.240770_dp

Definition at line 394 of file qmmm_gaussian_data.F.

◆ s16_a13

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a13 = 0.3219940_dp

Definition at line 395 of file qmmm_gaussian_data.F.

◆ s16_b13

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b13 = 0.945350_dp

Definition at line 395 of file qmmm_gaussian_data.F.

◆ s16_a14

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a14 = 0.0174978_dp

Definition at line 396 of file qmmm_gaussian_data.F.

◆ s16_b14

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b14 = 5.965260_dp

Definition at line 396 of file qmmm_gaussian_data.F.

◆ s16_a15

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a15 = 0.3677700_dp

Definition at line 397 of file qmmm_gaussian_data.F.

◆ s16_b15

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b15 = 0.540682_dp

Definition at line 397 of file qmmm_gaussian_data.F.

◆ s16_a16

real(kind=dp), parameter, public qmmm_gaussian_data::s16_a16 = 0.2742210_dp

Definition at line 398 of file qmmm_gaussian_data.F.

◆ s16_b16

real(kind=dp), parameter, public qmmm_gaussian_data::s16_b16 = 0.399796_dp

Definition at line 398 of file qmmm_gaussian_data.F.

◆ s17_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s17_rc = 0.15_dp

Definition at line 400 of file qmmm_gaussian_data.F.

◆ s17_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a1 = 0.0844127_dp

Definition at line 401 of file qmmm_gaussian_data.F.

◆ s17_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b1 = 3.242020_dp

Definition at line 401 of file qmmm_gaussian_data.F.

◆ s17_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a2 = 0.5321910_dp

Definition at line 402 of file qmmm_gaussian_data.F.

◆ s17_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b2 = 0.495959_dp

Definition at line 402 of file qmmm_gaussian_data.F.

◆ s17_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a3 = 0.4682070_dp

Definition at line 403 of file qmmm_gaussian_data.F.

◆ s17_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b3 = 0.659162_dp

Definition at line 403 of file qmmm_gaussian_data.F.

◆ s17_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a4 = 0.0316333_dp

Definition at line 404 of file qmmm_gaussian_data.F.

◆ s17_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b4 = 4.520730_dp

Definition at line 404 of file qmmm_gaussian_data.F.

◆ s17_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a5 = 0.1497940_dp

Definition at line 405 of file qmmm_gaussian_data.F.

◆ s17_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b5 = 1.957400_dp

Definition at line 405 of file qmmm_gaussian_data.F.

◆ s17_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a6 = 0.0181484_dp

Definition at line 406 of file qmmm_gaussian_data.F.

◆ s17_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b6 = 5.592050_dp

Definition at line 406 of file qmmm_gaussian_data.F.

◆ s17_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a7 = 0.0181805_dp

Definition at line 407 of file qmmm_gaussian_data.F.

◆ s17_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b7 = 5.592050_dp

Definition at line 407 of file qmmm_gaussian_data.F.

◆ s17_a8

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a8 = 0.4758870_dp

Definition at line 408 of file qmmm_gaussian_data.F.

◆ s17_b8

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b8 = 0.368353_dp

Definition at line 408 of file qmmm_gaussian_data.F.

◆ s17_a9

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a9 = 0.0474720_dp

Definition at line 409 of file qmmm_gaussian_data.F.

◆ s17_b9

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b9 = 4.043220_dp

Definition at line 409 of file qmmm_gaussian_data.F.

◆ s17_a10

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a10 = 0.2678960_dp

Definition at line 410 of file qmmm_gaussian_data.F.

◆ s17_b10

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b10 = 1.148850_dp

Definition at line 410 of file qmmm_gaussian_data.F.

◆ s17_a11

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a11 = 0.1998770_dp

Definition at line 411 of file qmmm_gaussian_data.F.

◆ s17_b11

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b11 = 1.504430_dp

Definition at line 411 of file qmmm_gaussian_data.F.

◆ s17_a12

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a12 = 0.0181970_dp

Definition at line 412 of file qmmm_gaussian_data.F.

◆ s17_b12

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b12 = 5.592050_dp

Definition at line 412 of file qmmm_gaussian_data.F.

◆ s17_a13

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a13 = 0.3261780_dp

Definition at line 413 of file qmmm_gaussian_data.F.

◆ s17_b13

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b13 = 0.265656_dp

Definition at line 413 of file qmmm_gaussian_data.F.

◆ s17_a14

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a14 = 0.1720050_dp

Definition at line 414 of file qmmm_gaussian_data.F.

◆ s17_b14

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b14 = 0.180302_dp

Definition at line 414 of file qmmm_gaussian_data.F.

◆ s17_a15

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a15 = 0.1127310_dp

Definition at line 415 of file qmmm_gaussian_data.F.

◆ s17_b15

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b15 = 2.529320_dp

Definition at line 415 of file qmmm_gaussian_data.F.

◆ s17_a16

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a16 = 0.3595840_dp

Definition at line 416 of file qmmm_gaussian_data.F.

◆ s17_b16

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b16 = 0.872121_dp

Definition at line 416 of file qmmm_gaussian_data.F.

◆ s17_a17

real(kind=dp), parameter, public qmmm_gaussian_data::s17_a17 = 0.0642967_dp

Definition at line 417 of file qmmm_gaussian_data.F.

◆ s17_b17

real(kind=dp), parameter, public qmmm_gaussian_data::s17_b17 = 0.105311_dp

Definition at line 417 of file qmmm_gaussian_data.F.

◆ s18_rc

real(kind=dp), parameter, public qmmm_gaussian_data::s18_rc = 0.05_dp

Definition at line 419 of file qmmm_gaussian_data.F.

◆ s18_a1

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a1 = 0.1013430_dp

Definition at line 420 of file qmmm_gaussian_data.F.

◆ s18_b1

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b1 = 0.0270641_dp

Definition at line 420 of file qmmm_gaussian_data.F.

◆ s18_a2

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a2 = 0.0583885_dp

Definition at line 421 of file qmmm_gaussian_data.F.

◆ s18_b2

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b2 = 4.2001100_dp

Definition at line 421 of file qmmm_gaussian_data.F.

◆ s18_a3

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a3 = 1.1587600_dp

Definition at line 422 of file qmmm_gaussian_data.F.

◆ s18_b3

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b3 = 0.3072560_dp

Definition at line 422 of file qmmm_gaussian_data.F.

◆ s18_a4

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a4 = 0.1255030_dp

Definition at line 423 of file qmmm_gaussian_data.F.

◆ s18_b4

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b4 = 2.3069300_dp

Definition at line 423 of file qmmm_gaussian_data.F.

◆ s18_a5

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a5 = 0.0469195_dp

Definition at line 424 of file qmmm_gaussian_data.F.

◆ s18_b5

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b5 = 3.5331200_dp

Definition at line 424 of file qmmm_gaussian_data.F.

◆ s18_a6

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a6 = 0.3728020_dp

Definition at line 425 of file qmmm_gaussian_data.F.

◆ s18_b6

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b6 = 0.0498868_dp

Definition at line 425 of file qmmm_gaussian_data.F.

◆ s18_a7

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a7 = 0.8990960_dp

Definition at line 426 of file qmmm_gaussian_data.F.

◆ s18_b7

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b7 = 0.0785500_dp

Definition at line 426 of file qmmm_gaussian_data.F.

◆ s18_a8

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a8 = 0.3146440_dp

Definition at line 427 of file qmmm_gaussian_data.F.

◆ s18_b8

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b8 = 1.0197600_dp

Definition at line 427 of file qmmm_gaussian_data.F.

◆ s18_a9

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a9 = 1.5250400_dp

Definition at line 428 of file qmmm_gaussian_data.F.

◆ s18_b9

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b9 = 0.1149420_dp

Definition at line 428 of file qmmm_gaussian_data.F.

◆ s18_a10

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a10 = 0.4308660_dp

Definition at line 429 of file qmmm_gaussian_data.F.

◆ s18_b10

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b10 = 0.7644820_dp

Definition at line 429 of file qmmm_gaussian_data.F.

◆ s18_a11

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a11 = 0.8278010_dp

Definition at line 430 of file qmmm_gaussian_data.F.

◆ s18_b11

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b11 = 0.4197150_dp

Definition at line 430 of file qmmm_gaussian_data.F.

◆ s18_a12

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a12 = 0.5947340_dp

Definition at line 431 of file qmmm_gaussian_data.F.

◆ s18_b12

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b12 = 0.5687230_dp

Definition at line 431 of file qmmm_gaussian_data.F.

◆ s18_a13

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a13 = 1.5771300_dp

Definition at line 432 of file qmmm_gaussian_data.F.

◆ s18_b13

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b13 = 0.2235160_dp

Definition at line 432 of file qmmm_gaussian_data.F.

◆ s18_a14

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a14 = 0.1707930_dp

Definition at line 433 of file qmmm_gaussian_data.F.

◆ s18_b14

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b14 = 1.7733300_dp

Definition at line 433 of file qmmm_gaussian_data.F.

◆ s18_a15

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a15 = 1.8160800_dp

Definition at line 434 of file qmmm_gaussian_data.F.

◆ s18_b15

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b15 = 0.1616990_dp

Definition at line 434 of file qmmm_gaussian_data.F.

◆ s18_a16

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a16 = 0.0857559_dp

Definition at line 435 of file qmmm_gaussian_data.F.

◆ s18_b16

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b16 = 2.9441700_dp

Definition at line 435 of file qmmm_gaussian_data.F.

◆ s18_a17

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a17 = 0.2313250_dp

Definition at line 436 of file qmmm_gaussian_data.F.

◆ s18_b17

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b17 = 1.3500600_dp

Definition at line 436 of file qmmm_gaussian_data.F.

◆ s18_a18

real(kind=dp), parameter, public qmmm_gaussian_data::s18_a18 = 0.0593302_dp

Definition at line 437 of file qmmm_gaussian_data.F.

◆ s18_b18

real(kind=dp), parameter, public qmmm_gaussian_data::s18_b18 = 5.4023800_dp

Definition at line 437 of file qmmm_gaussian_data.F.

Variables

Detailed Description

Variable Documentation

◆ min_geep_lib_gauss

◆ max_geep_lib_gauss

◆ g2_rc

◆ g2_a1

◆ g2_b1

◆ g2_a2

◆ g2_b2

◆ g3_rc

◆ g3_a1

◆ g3_b1

◆ g3_a2

◆ g3_b2

◆ g3_a3

◆ g3_b3

◆ g4_rc

◆ g4_a1

◆ g4_b1

◆ g4_a2

◆ g4_b2

◆ g4_a3

◆ g4_b3

◆ g4_a4

◆ g4_b4

◆ g5_rc

◆ g5_a1

◆ g5_b1

◆ g5_a2

◆ g5_b2

◆ g5_a3

◆ g5_b3

◆ g5_a4

◆ g5_b4

◆ g5_a5

◆ g5_b5

◆ g6_rc

◆ g6_a1

◆ g6_b1

◆ g6_a2

◆ g6_b2

◆ g6_a3

◆ g6_b3

◆ g6_a4

◆ g6_b4

◆ g6_a5

◆ g6_b5

◆ g6_a6

◆ g6_b6

◆ g7_rc

◆ g7_a1

◆ g7_b1

◆ g7_a2

◆ g7_b2

◆ g7_a3

◆ g7_b3

◆ g7_a4

◆ g7_b4

◆ g7_a5

◆ g7_b5

◆ g7_a6

◆ g7_b6

◆ g7_a7

◆ g7_b7

◆ g8_rc

◆ g8_a1

◆ g8_b1

◆ g8_a2

◆ g8_b2

◆ g8_a3

◆ g8_b3

◆ g8_a4

◆ g8_b4

◆ g8_a5

◆ g8_b5

◆ g8_a6

◆ g8_b6

◆ g8_a7

◆ g8_b7