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Searched refs:Cram_r_pack (Results 1 – 25 of 32) sorted by relevance

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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/band/lib/cpsp/
H A Dcpsp.F471 call Cram_r_pack(0,dbl_mb(Gx(1)))
472 call Cram_r_pack(0,dbl_mb(Gy(1)))
473 call Cram_r_pack(0,dbl_mb(Gz(1)))
576 call Cram_r_pack(0,dbl_mb(Gx(1)))
577 call Cram_r_pack(0,dbl_mb(Gy(1)))
578 call Cram_r_pack(0,dbl_mb(Gz(1)))
2073 call Cram_r_pack(0,tmp2)
2142 call Cram_r_pack(0,tmp2)
2146 call Cram_r_pack(0,tmp2)
2150 call Cram_r_pack(0,tmp2)
[all …]
H A Dcpsp_stress.F154 call Cram_r_pack(0,dbl_mb(G(1,1)))
155 call Cram_r_pack(0,dbl_mb(G(1,2)))
156 call Cram_r_pack(0,dbl_mb(G(1,3)))
334 call Cram_r_pack(nb,dbl_mb(G(1,1)))
335 call Cram_r_pack(nb,dbl_mb(G(1,2)))
336 call Cram_r_pack(nb,dbl_mb(G(1,3)))
622 call Cram_r_pack(0,tmp2)
635 call Cram_r_pack(nbq,tmp2)
647 call Cram_r_pack(0,tmp2)
H A Dc_semicore_force.F90 call Cram_r_pack(0,dbl_mb(Gx(1)))
91 call Cram_r_pack(0,dbl_mb(Gy(1)))
92 call Cram_r_pack(0,dbl_mb(Gz(1)))
H A Dcpsp_relativistic.F573 call Cram_r_pack(nb,dbl_mb(Gx(1)))
574 call Cram_r_pack(nb,dbl_mb(Gy(1)))
575 call Cram_r_pack(nb,dbl_mb(Gz(1)))
840 call Cram_r_pack(nb,dbl_mb(Gx(1)))
841 call Cram_r_pack(nb,dbl_mb(Gy(1)))
842 call Cram_r_pack(nb,dbl_mb(Gz(1)))
H A Dc_semicore.F438 call Cram_r_pack(0,dcpl_mb(Gu))
439 call Cram_r_pack(0,dcpl_mb(Gs))
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/band/lib/coulomb/
H A Dc_coulomb.F72 call Cram_r_pack(0,dbl_mb(tmp1(1)))
223 call Cram_r_pack(0,dbl_mb(G(1,1)))
224 call Cram_r_pack(0,dbl_mb(G(1,2)))
225 call Cram_r_pack(0,dbl_mb(G(1,3)))
H A Dc_coulomb_screened.F304 call Cram_r_pack(0,dbl_mb(gk2(1)))
618 call Cram_r_pack(0,dbl_mb(gk2(1)))
718 call Cram_r_pack(0,dbl_mb(gk2(1)))
827 call Cram_r_pack(0,dbl_mb(gk2(1)))
865 call Cram_r_pack(0,dbl_mb(gk2(1)))
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/band/lib/coulomb/
H A Dc_coulomb.F72 call Cram_r_pack(0,dbl_mb(tmp1(1)))
223 call Cram_r_pack(0,dbl_mb(G(1,1)))
224 call Cram_r_pack(0,dbl_mb(G(1,2)))
225 call Cram_r_pack(0,dbl_mb(G(1,3)))
H A Dc_coulomb_screened.F304 call Cram_r_pack(0,dbl_mb(gk2(1)))
618 call Cram_r_pack(0,dbl_mb(gk2(1)))
718 call Cram_r_pack(0,dbl_mb(gk2(1)))
827 call Cram_r_pack(0,dbl_mb(gk2(1)))
865 call Cram_r_pack(0,dbl_mb(gk2(1)))
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/band/lib/cpsp/
H A Dcpsp_stress.F154 call Cram_r_pack(0,dbl_mb(G(1,1)))
155 call Cram_r_pack(0,dbl_mb(G(1,2)))
156 call Cram_r_pack(0,dbl_mb(G(1,3)))
334 call Cram_r_pack(nb,dbl_mb(G(1,1)))
335 call Cram_r_pack(nb,dbl_mb(G(1,2)))
336 call Cram_r_pack(nb,dbl_mb(G(1,3)))
622 call Cram_r_pack(0,tmp2)
635 call Cram_r_pack(nbq,tmp2)
647 call Cram_r_pack(0,tmp2)
H A Dcpsp.F471 call Cram_r_pack(0,dbl_mb(Gx(1)))
472 call Cram_r_pack(0,dbl_mb(Gy(1)))
473 call Cram_r_pack(0,dbl_mb(Gz(1)))
576 call Cram_r_pack(0,dbl_mb(Gx(1)))
577 call Cram_r_pack(0,dbl_mb(Gy(1)))
578 call Cram_r_pack(0,dbl_mb(Gz(1)))
1695 call Cram_r_pack(0,tmp2)
1764 call Cram_r_pack(0,tmp2)
1768 call Cram_r_pack(0,tmp2)
1772 call Cram_r_pack(0,tmp2)
[all …]
H A Dc_semicore_force.F90 call Cram_r_pack(0,dbl_mb(Gx(1)))
91 call Cram_r_pack(0,dbl_mb(Gy(1)))
92 call Cram_r_pack(0,dbl_mb(Gz(1)))
H A Dcpsp_relativistic.F573 call Cram_r_pack(nb,dbl_mb(Gx(1)))
574 call Cram_r_pack(nb,dbl_mb(Gy(1)))
575 call Cram_r_pack(nb,dbl_mb(Gz(1)))
H A Dc_semicore.F438 call Cram_r_pack(0,dcpl_mb(Gu))
439 call Cram_r_pack(0,dcpl_mb(Gs))
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/band/lib/ke/
H A Dcke.F61 call Cram_r_pack(nb,dbl_mb(tmp1(1)))
97 call Cram_r_pack(nb,dbl_mb(tmp1(1)))
98 call Cram_r_pack(nb,dbl_mb(tmp2(1)))
395 call Cram_r_pack(nbq,dbl_mb(G(1,1)))
396 call Cram_r_pack(nbq,dbl_mb(G(1,2)))
397 call Cram_r_pack(nbq,dbl_mb(G(1,3)))
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/band/lib/ke/
H A Dcke.F61 call Cram_r_pack(nb,dbl_mb(tmp1(1)))
97 call Cram_r_pack(nb,dbl_mb(tmp1(1)))
98 call Cram_r_pack(nb,dbl_mb(tmp2(1)))
436 call Cram_r_pack(nbq,dbl_mb(G(1,1)))
437 call Cram_r_pack(nbq,dbl_mb(G(1,2)))
438 call Cram_r_pack(nbq,dbl_mb(G(1,3)))
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/band/analysis/APC/
H A Dband_atom_Efield.F96 call Cram_r_pack(0,dbl_mb(Gx(1)))
97 call Cram_r_pack(0,dbl_mb(Gy(1)))
98 call Cram_r_pack(0,dbl_mb(Gz(1)))
H A Dband_APC.F141 call Cram_r_pack(0,dbl_mb(tmp1(1)))
165 call Cram_r_pack(0,dbl_mb(tmp1(1)))
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/band/analysis/APC/
H A Dband_Efield.F96 call Cram_r_pack(0,dbl_mb(Gx(1)))
97 call Cram_r_pack(0,dbl_mb(Gy(1)))
98 call Cram_r_pack(0,dbl_mb(Gz(1)))
H A Dband_APC.F141 call Cram_r_pack(0,dbl_mb(tmp1(1)))
165 call Cram_r_pack(0,dbl_mb(tmp1(1)))
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/utilities/
H A Dkerker_G.F78 call Cram_r_pack(0,dbl_mb(tmp1(1)))
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/utilities/
H A Dkerker_G.F68 call Cram_r_pack(0,dbl_mb(tmp1(1)))
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/band/lib/ewald/
H A Dc_ewald.F728 call Cram_r_pack(0,dbl_mb(G(1,1)))
729 call Cram_r_pack(0,dbl_mb(G(1,2)))
730 call Cram_r_pack(0,dbl_mb(G(1,3)))
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/band/lib/ewald/
H A Dc_ewald.F728 call Cram_r_pack(0,dbl_mb(G(1,1)))
729 call Cram_r_pack(0,dbl_mb(G(1,2)))
730 call Cram_r_pack(0,dbl_mb(G(1,3)))
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/band/lib/borbs/
H A Dborbs.F522 call Cram_r_pack(nbq,tmp2)

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