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subroutine, public | input_cp2k_kpoints::create_kpoints_section (section) |
| Creates the Kpoints section SECTION: &kpoint... &end SCHEME [None, Gamma, Monkhorst-Pack, MacDonald, General] { nx ny nz } { nx ny nz sx sy sz } KPOINT x1 y1 z1 w1 SYMMETRY [on, off] WAVEFUNCTION [real, complex] FULL_GRID [on, off] VERBOSE [on, off] EPS_GEO value PARALLEL_GROUP_SIZE [-1,0,n]. More...
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subroutine, public | input_cp2k_kpoints::create_kpoint_set_section (section, section_name) |
| ... More...
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