Searched refs:my1_homo (Results 1 – 4 of 4) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | qs_cdft_methods.F | 157 my1, my1_homo, myexp, sum_cell_f_all, & local 406 my1_homo = my1 ! Homonuclear quantity needed for gradient 420 tmp_const = 1.0_dp - 2.0_dp*my1_homo* &
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H A D | mixed_cdft_methods.F | 3559 REAL(kind=dp) :: dist1, dist2, dmyexp, my1, my1_homo, & local 3991 my1_homo = my1 4004 … tmp_const = 1.0_dp - 2.0_dp*my1_homo*cdft_control%becke_control%aij(iatom, jatom)
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | qs_cdft_methods.F | 156 my1, my1_homo, myexp, sum_cell_f_all, & local 405 my1_homo = my1 ! Homonuclear quantity needed for gradient 419 tmp_const = 1.0_dp - 2.0_dp*my1_homo* &
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H A D | mixed_cdft_methods.F | 3551 REAL(kind=dp) :: dist1, dist2, dmyexp, my1, my1_homo, & local 3983 my1_homo = my1 3996 … tmp_const = 1.0_dp - 2.0_dp*my1_homo*cdft_control%becke_control%aij(iatom, jatom)
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