Searched refs:ion_q (Results 1 – 8 of 8) sorted by relevance
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/utilities/ |
H A D | nwpw_cdft.F | 40 real*8 ion_q 41 external ion_q
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H A D | nwpw_born.F | 134 real*8 ion_q,nwpw_born_radius 135 external ion_q,nwpw_born_radius 166 dbl_mb(vradii(1)+ii-1) = vdwr(nint(ion_q(ii)))/0.529177d0
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/band/dplot/ |
H A D | band_dplot.F | 977 real*8 lattice_unita,ion_rion,ion_q 979 external lattice_unita,ion_rion,ion_q 1053 q = ion_q(i) 1152 real*8 lattice_unita,ion_rion,ion_q 1154 external lattice_unita,ion_rion,ion_q 1371 q = ion_q(i) 1520 real*8 lattice_unita,ion_rion,ion_q 1522 external lattice_unita,ion_rion,ion_q 1739 q = ion_q(i)
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/band/dplot/ |
H A D | band_dplot.F | 976 real*8 lattice_unita,ion_rion,ion_q 978 external lattice_unita,ion_rion,ion_q 1052 q = ion_q(i) 1151 real*8 lattice_unita,ion_rion,ion_q 1153 external lattice_unita,ion_rion,ion_q 1370 q = ion_q(i) 1519 real*8 lattice_unita,ion_rion,ion_q 1521 external lattice_unita,ion_rion,ion_q 1738 q = ion_q(i)
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/pspw/dplot/ |
H A D | pspw_dplot.F | 941 real*8 lattice_unita,ion_rion,ion_q local 943 external lattice_unita,ion_rion,ion_q 1060 q = ion_q(i) 1584 real*8 lattice_unita,ion_rion,ion_q local 1586 external lattice_unita,ion_rion,ion_q 1807 q = ion_q(i) 1961 real*8 lattice_unita,ion_rion,ion_q local 1963 external lattice_unita,ion_rion,ion_q
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/pspw/dplot/ |
H A D | pspw_dplot.F | 941 real*8 lattice_unita,ion_rion,ion_q 943 external lattice_unita,ion_rion,ion_q 1060 q = ion_q(i) 1584 real*8 lattice_unita,ion_rion,ion_q 1586 external lattice_unita,ion_rion,ion_q 1807 q = ion_q(i) 1961 real*8 lattice_unita,ion_rion,ion_q 1963 external lattice_unita,ion_rion,ion_q
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/ion/ |
H A D | ion.F | 1001 real*8 function ion_q(i) 1020 ion_q = q 1082 real*8 ion_q 1085 external ion_q 1095 > q = ion_q(i) 1120 real*8 ion_q 1123 external ion_q 1135 atn = nint(ion_q(ii))
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/ion/ |
H A D | ion.F | 991 real*8 function ion_q(i) 1010 ion_q = q 1072 real*8 ion_q 1075 external ion_q 1085 > q = ion_q(i) 1110 real*8 ion_q 1113 external ion_q 1125 atn = nint(ion_q(ii))
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