Searched refs:dim_geo_nuc (Results 1 – 6 of 6) sorted by relevance
/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/external/gen1int/src/ecp/ |
H A D | contr_cgto_ecp_local.F90 | 158 …integer dim_geo_nuc !dimension of geometric derivatives on operator centers before scatter… local 227 dim_geo_nuc = (order_part_cent(3)+1)*(order_part_cent(3)+2)/2 230 dim_geo_nuc,num_elec), stat=ierr) 255 dim_cints, dim_geo_bra, dim_geo_ket, dim_geo_nuc, &
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H A D | contr_cgto_ecp_non.F90 | 158 …integer dim_geo_nuc !dimension of geometric derivatives on operator centers before scatter… local 227 dim_geo_nuc = (order_part_cent(3)+1)*(order_part_cent(3)+2)/2 230 dim_geo_nuc,num_elec), stat=ierr) 255 dim_cints, dim_geo_bra, dim_geo_ket, dim_geo_nuc, &
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/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/external/gen1int/src/isdpot/ |
H A D | contr_cgto_isdpot.F90 | 158 …integer dim_geo_nuc !dimension of geometric derivatives on operator centers before scatter… local 227 dim_geo_nuc = (order_part_cent(3)+1)*(order_part_cent(3)+2)/2 230 dim_geo_nuc,num_elec), stat=ierr) 255 dim_cints, dim_geo_bra, dim_geo_ket, dim_geo_nuc, &
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/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/external/gen1int/src/mcp1/ |
H A D | contr_cgto_mcp1_core.F90 | 158 …integer dim_geo_nuc !dimension of geometric derivatives on operator centers before scatter… local 227 dim_geo_nuc = (order_part_cent(3)+1)*(order_part_cent(3)+2)/2 230 dim_geo_nuc,num_elec), stat=ierr) 255 dim_cints, dim_geo_bra, dim_geo_ket, dim_geo_nuc, &
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H A D | contr_cgto_mcp1_pot.F90 | 158 …integer dim_geo_nuc !dimension of geometric derivatives on operator centers before scatter… local 227 dim_geo_nuc = (order_part_cent(3)+1)*(order_part_cent(3)+2)/2 230 dim_geo_nuc,num_elec), stat=ierr) 255 dim_cints, dim_geo_bra, dim_geo_ket, dim_geo_nuc, &
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/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/external/gen1int/src/dso/ |
H A D | contr_cgto_dso.F90 | 158 …integer dim_geo_nuc !dimension of geometric derivatives on operator centers before scatter… local 227 dim_geo_nuc = (order_part_cent(3)+1)*(order_part_cent(3)+2)/2 230 dim_geo_nuc,num_elec), stat=ierr) 255 dim_cints, dim_geo_bra, dim_geo_ket, dim_geo_nuc, &
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