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Here is a list of all namespace variables with links to the namespace documentation for each variable:
- s -
s10_a1 :
qmmm_gaussian_data
s10_a10 :
qmmm_gaussian_data
s10_a2 :
qmmm_gaussian_data
s10_a3 :
qmmm_gaussian_data
s10_a4 :
qmmm_gaussian_data
s10_a5 :
qmmm_gaussian_data
s10_a6 :
qmmm_gaussian_data
s10_a7 :
qmmm_gaussian_data
s10_a8 :
qmmm_gaussian_data
s10_a9 :
qmmm_gaussian_data
s10_b1 :
qmmm_gaussian_data
s10_b10 :
qmmm_gaussian_data
s10_b2 :
qmmm_gaussian_data
s10_b3 :
qmmm_gaussian_data
s10_b4 :
qmmm_gaussian_data
s10_b5 :
qmmm_gaussian_data
s10_b6 :
qmmm_gaussian_data
s10_b7 :
qmmm_gaussian_data
s10_b8 :
qmmm_gaussian_data
s10_b9 :
qmmm_gaussian_data
s10_rc :
qmmm_gaussian_data
s11_a1 :
qmmm_gaussian_data
s11_a10 :
qmmm_gaussian_data
s11_a11 :
qmmm_gaussian_data
s11_a2 :
qmmm_gaussian_data
s11_a3 :
qmmm_gaussian_data
s11_a4 :
qmmm_gaussian_data
s11_a5 :
qmmm_gaussian_data
s11_a6 :
qmmm_gaussian_data
s11_a7 :
qmmm_gaussian_data
s11_a8 :
qmmm_gaussian_data
s11_a9 :
qmmm_gaussian_data
s11_b1 :
qmmm_gaussian_data
s11_b10 :
qmmm_gaussian_data
s11_b11 :
qmmm_gaussian_data
s11_b2 :
qmmm_gaussian_data
s11_b3 :
qmmm_gaussian_data
s11_b4 :
qmmm_gaussian_data
s11_b5 :
qmmm_gaussian_data
s11_b6 :
qmmm_gaussian_data
s11_b7 :
qmmm_gaussian_data
s11_b8 :
qmmm_gaussian_data
s11_b9 :
qmmm_gaussian_data
s11_rc :
qmmm_gaussian_data
s12_a1 :
qmmm_gaussian_data
s12_a10 :
qmmm_gaussian_data
s12_a11 :
qmmm_gaussian_data
s12_a12 :
qmmm_gaussian_data
s12_a2 :
qmmm_gaussian_data
s12_a3 :
qmmm_gaussian_data
s12_a4 :
qmmm_gaussian_data
s12_a5 :
qmmm_gaussian_data
s12_a6 :
qmmm_gaussian_data
s12_a7 :
qmmm_gaussian_data
s12_a8 :
qmmm_gaussian_data
s12_a9 :
qmmm_gaussian_data
s12_b1 :
qmmm_gaussian_data
s12_b10 :
qmmm_gaussian_data
s12_b11 :
qmmm_gaussian_data
s12_b12 :
qmmm_gaussian_data
s12_b2 :
qmmm_gaussian_data
s12_b3 :
qmmm_gaussian_data
s12_b4 :
qmmm_gaussian_data
s12_b5 :
qmmm_gaussian_data
s12_b6 :
qmmm_gaussian_data
s12_b7 :
qmmm_gaussian_data
s12_b8 :
qmmm_gaussian_data
s12_b9 :
qmmm_gaussian_data
s12_rc :
qmmm_gaussian_data
s13_a1 :
qmmm_gaussian_data
s13_a10 :
qmmm_gaussian_data
s13_a11 :
qmmm_gaussian_data
s13_a12 :
qmmm_gaussian_data
s13_a13 :
qmmm_gaussian_data
s13_a2 :
qmmm_gaussian_data
s13_a3 :
qmmm_gaussian_data
s13_a4 :
qmmm_gaussian_data
s13_a5 :
qmmm_gaussian_data
s13_a6 :
qmmm_gaussian_data
s13_a7 :
qmmm_gaussian_data
s13_a8 :
qmmm_gaussian_data
s13_a9 :
qmmm_gaussian_data
s13_b1 :
qmmm_gaussian_data
s13_b10 :
qmmm_gaussian_data
s13_b11 :
qmmm_gaussian_data
s13_b12 :
qmmm_gaussian_data
s13_b13 :
qmmm_gaussian_data
s13_b2 :
qmmm_gaussian_data
s13_b3 :
qmmm_gaussian_data
s13_b4 :
qmmm_gaussian_data
s13_b5 :
qmmm_gaussian_data
s13_b6 :
qmmm_gaussian_data
s13_b7 :
qmmm_gaussian_data
s13_b8 :
qmmm_gaussian_data
s13_b9 :
qmmm_gaussian_data
s13_rc :
qmmm_gaussian_data
s14_a1 :
qmmm_gaussian_data
s14_a10 :
qmmm_gaussian_data
s14_a11 :
qmmm_gaussian_data
s14_a12 :
qmmm_gaussian_data
s14_a13 :
qmmm_gaussian_data
s14_a14 :
qmmm_gaussian_data
s14_a2 :
qmmm_gaussian_data
s14_a3 :
qmmm_gaussian_data
s14_a4 :
qmmm_gaussian_data
s14_a5 :
qmmm_gaussian_data
s14_a6 :
qmmm_gaussian_data
s14_a7 :
qmmm_gaussian_data
s14_a8 :
qmmm_gaussian_data
s14_a9 :
qmmm_gaussian_data
s14_b1 :
qmmm_gaussian_data
s14_b10 :
qmmm_gaussian_data
s14_b11 :
qmmm_gaussian_data
s14_b12 :
qmmm_gaussian_data
s14_b13 :
qmmm_gaussian_data
s14_b14 :
qmmm_gaussian_data
s14_b2 :
qmmm_gaussian_data
s14_b3 :
qmmm_gaussian_data
s14_b4 :
qmmm_gaussian_data
s14_b5 :
qmmm_gaussian_data
s14_b6 :
qmmm_gaussian_data
s14_b7 :
qmmm_gaussian_data
s14_b8 :
qmmm_gaussian_data
s14_b9 :
qmmm_gaussian_data
s14_rc :
qmmm_gaussian_data
s15_a1 :
qmmm_gaussian_data
s15_a10 :
qmmm_gaussian_data
s15_a11 :
qmmm_gaussian_data
s15_a12 :
qmmm_gaussian_data
s15_a13 :
qmmm_gaussian_data
s15_a14 :
qmmm_gaussian_data
s15_a15 :
qmmm_gaussian_data
s15_a2 :
qmmm_gaussian_data
s15_a3 :
qmmm_gaussian_data
s15_a4 :
qmmm_gaussian_data
s15_a5 :
qmmm_gaussian_data
s15_a6 :
qmmm_gaussian_data
s15_a7 :
qmmm_gaussian_data
s15_a8 :
qmmm_gaussian_data
s15_a9 :
qmmm_gaussian_data
s15_b1 :
qmmm_gaussian_data
s15_b10 :
qmmm_gaussian_data
s15_b11 :
qmmm_gaussian_data
s15_b12 :
qmmm_gaussian_data
s15_b13 :
qmmm_gaussian_data
s15_b14 :
qmmm_gaussian_data
s15_b15 :
qmmm_gaussian_data
s15_b2 :
qmmm_gaussian_data
s15_b3 :
qmmm_gaussian_data
s15_b4 :
qmmm_gaussian_data
s15_b5 :
qmmm_gaussian_data
s15_b6 :
qmmm_gaussian_data
s15_b7 :
qmmm_gaussian_data
s15_b8 :
qmmm_gaussian_data
s15_b9 :
qmmm_gaussian_data
s15_rc :
qmmm_gaussian_data
s16_a1 :
qmmm_gaussian_data
s16_a10 :
qmmm_gaussian_data
s16_a11 :
qmmm_gaussian_data
s16_a12 :
qmmm_gaussian_data
s16_a13 :
qmmm_gaussian_data
s16_a14 :
qmmm_gaussian_data
s16_a15 :
qmmm_gaussian_data
s16_a16 :
qmmm_gaussian_data
s16_a2 :
qmmm_gaussian_data
s16_a3 :
qmmm_gaussian_data
s16_a4 :
qmmm_gaussian_data
s16_a5 :
qmmm_gaussian_data
s16_a6 :
qmmm_gaussian_data
s16_a7 :
qmmm_gaussian_data
s16_a8 :
qmmm_gaussian_data
s16_a9 :
qmmm_gaussian_data
s16_b1 :
qmmm_gaussian_data
s16_b10 :
qmmm_gaussian_data
s16_b11 :
qmmm_gaussian_data
s16_b12 :
qmmm_gaussian_data
s16_b13 :
qmmm_gaussian_data
s16_b14 :
qmmm_gaussian_data
s16_b15 :
qmmm_gaussian_data
s16_b16 :
qmmm_gaussian_data
s16_b2 :
qmmm_gaussian_data
s16_b3 :
qmmm_gaussian_data
s16_b4 :
qmmm_gaussian_data
s16_b5 :
qmmm_gaussian_data
s16_b6 :
qmmm_gaussian_data
s16_b7 :
qmmm_gaussian_data
s16_b8 :
qmmm_gaussian_data
s16_b9 :
qmmm_gaussian_data
s16_rc :
qmmm_gaussian_data
s17_a1 :
qmmm_gaussian_data
s17_a10 :
qmmm_gaussian_data
s17_a11 :
qmmm_gaussian_data
s17_a12 :
qmmm_gaussian_data
s17_a13 :
qmmm_gaussian_data
s17_a14 :
qmmm_gaussian_data
s17_a15 :
qmmm_gaussian_data
s17_a16 :
qmmm_gaussian_data
s17_a17 :
qmmm_gaussian_data
s17_a2 :
qmmm_gaussian_data
s17_a3 :
qmmm_gaussian_data
s17_a4 :
qmmm_gaussian_data
s17_a5 :
qmmm_gaussian_data
s17_a6 :
qmmm_gaussian_data
s17_a7 :
qmmm_gaussian_data
s17_a8 :
qmmm_gaussian_data
s17_a9 :
qmmm_gaussian_data
s17_b1 :
qmmm_gaussian_data
s17_b10 :
qmmm_gaussian_data
s17_b11 :
qmmm_gaussian_data
s17_b12 :
qmmm_gaussian_data
s17_b13 :
qmmm_gaussian_data
s17_b14 :
qmmm_gaussian_data
s17_b15 :
qmmm_gaussian_data
s17_b16 :
qmmm_gaussian_data
s17_b17 :
qmmm_gaussian_data
s17_b2 :
qmmm_gaussian_data
s17_b3 :
qmmm_gaussian_data
s17_b4 :
qmmm_gaussian_data
s17_b5 :
qmmm_gaussian_data
s17_b6 :
qmmm_gaussian_data
s17_b7 :
qmmm_gaussian_data
s17_b8 :
qmmm_gaussian_data
s17_b9 :
qmmm_gaussian_data
s17_rc :
qmmm_gaussian_data
s18_a1 :
qmmm_gaussian_data
s18_a10 :
qmmm_gaussian_data
s18_a11 :
qmmm_gaussian_data
s18_a12 :
qmmm_gaussian_data
s18_a13 :
qmmm_gaussian_data
s18_a14 :
qmmm_gaussian_data
s18_a15 :
qmmm_gaussian_data
s18_a16 :
qmmm_gaussian_data
s18_a17 :
qmmm_gaussian_data
s18_a18 :
qmmm_gaussian_data
s18_a2 :
qmmm_gaussian_data
s18_a3 :
qmmm_gaussian_data
s18_a4 :
qmmm_gaussian_data
s18_a5 :
qmmm_gaussian_data
s18_a6 :
qmmm_gaussian_data
s18_a7 :
qmmm_gaussian_data
s18_a8 :
qmmm_gaussian_data
s18_a9 :
qmmm_gaussian_data
s18_b1 :
qmmm_gaussian_data
s18_b10 :
qmmm_gaussian_data
s18_b11 :
qmmm_gaussian_data
s18_b12 :
qmmm_gaussian_data
s18_b13 :
qmmm_gaussian_data
s18_b14 :
qmmm_gaussian_data
s18_b15 :
qmmm_gaussian_data
s18_b16 :
qmmm_gaussian_data
s18_b17 :
qmmm_gaussian_data
s18_b18 :
qmmm_gaussian_data
s18_b2 :
qmmm_gaussian_data
s18_b3 :
qmmm_gaussian_data
s18_b4 :
qmmm_gaussian_data
s18_b5 :
qmmm_gaussian_data
s18_b6 :
qmmm_gaussian_data
s18_b7 :
qmmm_gaussian_data
s18_b8 :
qmmm_gaussian_data
s18_b9 :
qmmm_gaussian_data
s18_rc :
qmmm_gaussian_data
s2_a1 :
qmmm_gaussian_data
s2_a2 :
qmmm_gaussian_data
s2_b1 :
qmmm_gaussian_data
s2_b2 :
qmmm_gaussian_data
s2_rc :
qmmm_gaussian_data
s3_a1 :
qmmm_gaussian_data
s3_a2 :
qmmm_gaussian_data
s3_a3 :
qmmm_gaussian_data
s3_b1 :
qmmm_gaussian_data
s3_b2 :
qmmm_gaussian_data
s3_b3 :
qmmm_gaussian_data
s3_rc :
qmmm_gaussian_data
s4_a1 :
qmmm_gaussian_data
s4_a2 :
qmmm_gaussian_data
s4_a3 :
qmmm_gaussian_data
s4_a4 :
qmmm_gaussian_data
s4_b1 :
qmmm_gaussian_data
s4_b2 :
qmmm_gaussian_data
s4_b3 :
qmmm_gaussian_data
s4_b4 :
qmmm_gaussian_data
s4_rc :
qmmm_gaussian_data
s5_a1 :
qmmm_gaussian_data
s5_a2 :
qmmm_gaussian_data
s5_a3 :
qmmm_gaussian_data
s5_a4 :
qmmm_gaussian_data
s5_a5 :
qmmm_gaussian_data
s5_b1 :
qmmm_gaussian_data
s5_b2 :
qmmm_gaussian_data
s5_b3 :
qmmm_gaussian_data
s5_b4 :
qmmm_gaussian_data
s5_b5 :
qmmm_gaussian_data
s5_rc :
qmmm_gaussian_data
s6_a1 :
qmmm_gaussian_data
s6_a2 :
qmmm_gaussian_data
s6_a3 :
qmmm_gaussian_data
s6_a4 :
qmmm_gaussian_data
s6_a5 :
qmmm_gaussian_data
s6_a6 :
qmmm_gaussian_data
s6_b1 :
qmmm_gaussian_data
s6_b2 :
qmmm_gaussian_data
s6_b3 :
qmmm_gaussian_data
s6_b4 :
qmmm_gaussian_data
s6_b5 :
qmmm_gaussian_data
s6_b6 :
qmmm_gaussian_data
s6_rc :
qmmm_gaussian_data
s7_a1 :
qmmm_gaussian_data
s7_a2 :
qmmm_gaussian_data
s7_a3 :
qmmm_gaussian_data
s7_a4 :
qmmm_gaussian_data
s7_a5 :
qmmm_gaussian_data
s7_a6 :
qmmm_gaussian_data
s7_a7 :
qmmm_gaussian_data
s7_b1 :
qmmm_gaussian_data
s7_b2 :
qmmm_gaussian_data
s7_b3 :
qmmm_gaussian_data
s7_b4 :
qmmm_gaussian_data
s7_b5 :
qmmm_gaussian_data
s7_b6 :
qmmm_gaussian_data
s7_b7 :
qmmm_gaussian_data
s7_rc :
qmmm_gaussian_data
s8_a1 :
qmmm_gaussian_data
s8_a2 :
qmmm_gaussian_data
s8_a3 :
qmmm_gaussian_data
s8_a4 :
qmmm_gaussian_data
s8_a5 :
qmmm_gaussian_data
s8_a6 :
qmmm_gaussian_data
s8_a7 :
qmmm_gaussian_data
s8_a8 :
qmmm_gaussian_data
s8_b1 :
qmmm_gaussian_data
s8_b2 :
qmmm_gaussian_data
s8_b3 :
qmmm_gaussian_data
s8_b4 :
qmmm_gaussian_data
s8_b5 :
qmmm_gaussian_data
s8_b6 :
qmmm_gaussian_data
s8_b7 :
qmmm_gaussian_data
s8_b8 :
qmmm_gaussian_data
s8_rc :
qmmm_gaussian_data
s9_a1 :
qmmm_gaussian_data
s9_a2 :
qmmm_gaussian_data
s9_a3 :
qmmm_gaussian_data
s9_a4 :
qmmm_gaussian_data
s9_a5 :
qmmm_gaussian_data
s9_a6 :
qmmm_gaussian_data
s9_a7 :
qmmm_gaussian_data
s9_a8 :
qmmm_gaussian_data
s9_a9 :
qmmm_gaussian_data
s9_b1 :
qmmm_gaussian_data
s9_b2 :
qmmm_gaussian_data
s9_b3 :
qmmm_gaussian_data
s9_b4 :
qmmm_gaussian_data
s9_b5 :
qmmm_gaussian_data
s9_b6 :
qmmm_gaussian_data
s9_b7 :
qmmm_gaussian_data
s9_b8 :
qmmm_gaussian_data
s9_b9 :
qmmm_gaussian_data
s9_rc :
qmmm_gaussian_data
sabatini2013 :
bibliography
sander2015 :
bibliography
scan_x :
input_constants
scan_xy :
input_constants
scan_xyz :
input_constants
scan_xz :
input_constants
scan_y :
input_constants
scan_yz :
input_constants
scan_z :
input_constants
sccs_andreussi :
input_constants
sccs_derivative_cd3 :
input_constants
sccs_derivative_cd5 :
input_constants
sccs_derivative_cd7 :
input_constants
sccs_derivative_fft :
input_constants
sccs_fattebert_gygi :
input_constants
schambeck2024 :
bibliography
scheiber2018 :
bibliography
schenter2008 :
bibliography
schiffmann2015 :
bibliography
schonherr2014 :
bibliography
schran2020a :
bibliography
schran2020b :
bibliography
schreiber2008 :
bibliography
schuett2016 :
bibliography
schuett2018 :
bibliography
se_map_alm :
semi_empirical_int_arrays
se_orbital_pointer :
semi_empirical_int_arrays
sebastiani2001 :
bibliography
seconds :
physcon
seifert1996 :
bibliography
select_row :
domain_submatrix_types
select_row_col :
domain_submatrix_types
send_msg :
tmc_messages
sertcan2024 :
bibliography
setyawan2010 :
bibliography
sgp_pseudo :
input_constants
sh_sh :
pair_potential_types
shao2003 :
bibliography
shape_function_density :
input_constants
shape_function_gaussian :
input_constants
shigeta2001 :
bibliography
sic_ad :
input_constants
sic_eo :
input_constants
sic_list_all :
input_constants
sic_list_unpaired :
input_constants
sic_mauri_spz :
input_constants
sic_mauri_us :
input_constants
sic_none :
input_constants
siepmann1995 :
bibliography
siepmann_type :
pair_potential_types
sigma_none :
input_constants
sigma_pbe0_s1 :
input_constants
sigma_pbe0_s2 :
input_constants
sigma_pbe_s1 :
input_constants
sigma_pbe_s2 :
input_constants
silent_print_level :
cp_output_handling
sirius_func_vdwdf :
input_cp2k_pwdft
sirius_func_vdwdf2 :
input_cp2k_pwdft
sirius_func_vdwdfcx :
input_cp2k_pwdft
sirius_no_vdw :
input_cp2k_pwdft
slater :
input_constants
small_cell_full_kp :
input_constants
smeagol_bulklead_left :
input_constants
smeagol_bulklead_leftright :
input_constants
smeagol_bulklead_right :
input_constants
smeagol_gridmethod_adaptive :
input_constants
smeagol_gridmethod_traditional :
input_constants
smeagol_integraltype_gauss_chebyshev :
input_constants
smeagol_integraltype_gauss_legendre :
input_constants
smeagol_method_nr :
qs_scf_types
smeagol_runtype_bulktransport :
input_constants
smeagol_runtype_emtransport :
input_constants
smear_energy_window :
input_constants
smear_fermi_dirac :
input_constants
smear_list :
input_constants
soc_lda :
input_constants
soc_none :
input_constants
soc_pbe :
input_constants
solca2024 :
bibliography
soset :
orbital_pointers
souza2002 :
bibliography
sp :
fft_kinds
,
kinds
sp_size :
kinds
sparse_guess :
input_constants
spatially_dependent :
dielectric_types
spatially_rho_dependent :
dielectric_types
spd_inversion_dense_cholesky :
input_constants
spd_inversion_ls_hotelling :
input_constants
spd_inversion_ls_taylor :
input_constants
special_diag_method_nr :
qs_scf_types
spl3_1d_coeffs0 :
pw_spline_utils
spl3_1d_transf_border1 :
pw_spline_utils
spl3_1d_transf_coeffs :
pw_spline_utils
spl3_aint_coeff :
pw_spline_utils
spl3_precond1_coeff :
pw_spline_utils
spla_threshold :
rpa_grad
spline2_coeffs :
pw_spline_utils
spline2_deriv_coeffs :
pw_spline_utils
spline3_coeffs :
pw_spline_utils
spline3_deriv_coeffs :
pw_spline_utils
spline3_nopbc_interp :
cp_spline_utils
spline3_pbc_interp :
cp_spline_utils
sqrt105 :
mathconstants
sqrt15 :
mathconstants
sqrt2 :
mathconstants
sqrt21 :
mathconstants
sqrt3 :
mathconstants
sqrt35 :
mathconstants
sqrt5 :
mathconstants
sqrt7 :
mathconstants
sqrthalf :
mathconstants
sr_shape_arc :
negf_integr_simpson
sr_shape_linear :
negf_integr_simpson
ss :
ai_overlap_debug
sss :
ai_overlap3_debug
state_loc_all :
input_constants
state_loc_list :
input_constants
state_loc_mixed :
input_constants
state_loc_none :
input_constants
state_loc_range :
input_constants
status_accepted :
tmc_tree_types
status_accepted_result :
tmc_tree_types
status_calc_approx_ener :
tmc_tree_types
status_calculate_energy :
tmc_tree_types
status_calculate_md :
tmc_tree_types
status_calculate_nmc_steps :
tmc_tree_types
status_calculated :
tmc_tree_types
status_cancel_ener :
tmc_tree_types
status_cancel_nmc :
tmc_tree_types
status_canceled_ener :
tmc_tree_types
status_canceled_nmc :
tmc_tree_types
status_created :
tmc_tree_types
status_deleted :
tmc_tree_types
status_deleted_result :
tmc_tree_types
status_frozen :
tmc_tree_types
status_ok :
tmc_tree_types
status_proton_disorder :
tmc_tree_types
status_rejected :
tmc_tree_types
status_rejected_result :
tmc_tree_types
staub2019 :
bibliography
stein2022 :
bibliography
stein2024 :
bibliography
stengel2009 :
bibliography
stewart1982 :
bibliography
stewart1989 :
bibliography
stewart2007 :
bibliography
sto_basis :
atom_types
stoychev2016 :
bibliography
swarm_do_glbopt :
input_constants
symmetric_ij :
qs_tensors_types
symmetric_ijk :
qs_tensors_types
symmetric_jk :
qs_tensors_types
symmetric_none :
qs_tensors_types
symmetrik_ik :
qs_tensors_types
Generated by
1.9.8
1.9.8