/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/NWints/api/ |
H A D | int_1estv.F | 130 integer i_nbf_s, j_nbf_s local 323 j_nbf_s = int_nbf_s(Lj) 342 j_nbf_s = j_nbf_x 360 j_nbf_s = int_nbf_s(Lj) 824 integer i_nbf_s, j_nbf_s local 1031 j_nbf_s = int_nbf_s(Lj) 1050 j_nbf_s = j_nbf_x 1196 integer i_nbf_s, j_nbf_s local 1436 j_nbf_s = j_nbf_x 1598 integer i_nbf_s, j_nbf_s local [all …]
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H A D | intdd_1eh1.F | 156 integer i_nbf_s, j_nbf_s 246 j_nbf_s = int_nbf_s(Jtype) 253 & j_nbf_s,i_nbf_s,Itype,igen, 263 & j_nbf_s,i_nbf_s,Itype,igen, 273 j_nbf_s = j_nbf_x 279 & j_nbf_s,i_nbf_s,Itype,igen, 289 & j_nbf_s,i_nbf_s,Itype,igen, 299 j_nbf_s = int_nbf_s(Jtype) 305 & j_nbf_s,i_nbf_s,0,igen, 315 & j_nbf_s,i_nbf_s,0,igen, [all …]
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H A D | intdd_1eov.F | 151 integer i_nbf_s, j_nbf_s 254 j_nbf_s = int_nbf_s(Jtype) 261 & j_nbf_s,i_nbf_s,Itype,igen, 271 j_nbf_s = j_nbf_x 277 & j_nbf_s,i_nbf_s,Itype,igen, 287 j_nbf_s = int_nbf_s(Jtype) 293 & j_nbf_s,i_nbf_s,0,igen, 307 nint_s = i_nbf_s*j_nbf_s
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H A D | int_1epvpe.F | 66 integer i_nbf_s, j_nbf_s local 181 j_nbf_s = int_nbf_s(Lj) 185 & j_nbf_s,i_nbf_s,Li,i_gen, 192 j_nbf_s = j_nbf_x 195 & j_nbf_s,i_nbf_s,Li,i_gen, 202 j_nbf_s = int_nbf_s(Lj) 205 & j_nbf_s,i_nbf_s,0,i_gen,
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H A D | int_1epxvpe.F | 67 integer i_nbf_s, j_nbf_s, icomp local 150 j_nbf_s = int_nbf_s(Lj) 155 & j_nbf_s,i_nbf_s,Li,i_gen, 163 j_nbf_s = j_nbf_x 167 & j_nbf_s,i_nbf_s,Li,i_gen, 175 j_nbf_s = int_nbf_s(Lj) 179 & j_nbf_s,i_nbf_s,0,i_gen,
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H A D | int_vstat1e.F | 69 integer i_nbf_s, j_nbf_s local 166 j_nbf_s = int_nbf_s(Lj) 170 & j_nbf_s,i_nbf_s,Li,i_gen, 177 j_nbf_s = j_nbf_x 180 & j_nbf_s,i_nbf_s,Li,i_gen, 187 j_nbf_s = int_nbf_s(Lj) 190 & j_nbf_s,i_nbf_s,0,i_gen,
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H A D | intdd_1eecp1.F | 145 integer i_nbf_s, j_nbf_s 252 j_nbf_s = int_nbf_s(Jtype) 259 & j_nbf_s,i_nbf_s,Itype,igen, 269 j_nbf_s = j_nbf_x 275 & j_nbf_s,i_nbf_s,Itype,igen, 285 j_nbf_s = int_nbf_s(Jtype) 291 & j_nbf_s,i_nbf_s,0,igen, 304 nint_s = i_nbf_s*j_nbf_s
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H A D | intd_1eov.F | 158 integer i_nbf_s, j_nbf_s local 345 j_nbf_s = int_nbf_s(Jtype) 351 & j_nbf_s,i_nbf_s,Itype,igen, 360 j_nbf_s = j_nbf_x 365 & j_nbf_s,i_nbf_s,Itype,igen, 374 j_nbf_s = int_nbf_s(Jtype) 379 & j_nbf_s,i_nbf_s,0,igen, 392 nint_s = i_nbf_s*j_nbf_s
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H A D | intd_1eke.F | 153 integer i_nbf_s, j_nbf_s local 339 j_nbf_s = int_nbf_s(Jtype) 345 & j_nbf_s,i_nbf_s,Itype,igen, 354 j_nbf_s = j_nbf_x 359 & j_nbf_s,i_nbf_s,Itype,igen, 368 j_nbf_s = int_nbf_s(Jtype) 373 & j_nbf_s,i_nbf_s,0,igen, 386 nint_s = i_nbf_s*j_nbf_s
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H A D | intd_1epot_cosmo.F | 194 integer i_nbf_s, j_nbf_s local 491 j_nbf_s = int_nbf_s(Jtype) 497 & j_nbf_s,i_nbf_s,Itype,igen, 506 j_nbf_s = j_nbf_x 511 & j_nbf_s,i_nbf_s,Itype,igen, 520 j_nbf_s = int_nbf_s(Jtype) 525 & j_nbf_s,i_nbf_s,0,igen, 538 nint_s = i_nbf_s*j_nbf_s
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H A D | intd_1eh1.F | 169 integer i_nbf_s, j_nbf_s local 416 j_nbf_s = int_nbf_s(Jtype) 422 & j_nbf_s,i_nbf_s,Itype,igen, 431 j_nbf_s = j_nbf_x 436 & j_nbf_s,i_nbf_s,Itype,igen, 445 j_nbf_s = int_nbf_s(Jtype) 450 & j_nbf_s,i_nbf_s,0,igen, 463 nint_s = i_nbf_s*j_nbf_s
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H A D | intd_1epot.F | 167 integer i_nbf_s, j_nbf_s local 460 j_nbf_s = int_nbf_s(Jtype) 466 & j_nbf_s,i_nbf_s,Itype,igen, 475 j_nbf_s = j_nbf_x 480 & j_nbf_s,i_nbf_s,Itype,igen, 489 j_nbf_s = int_nbf_s(Jtype) 494 & j_nbf_s,i_nbf_s,0,igen, 507 nint_s = i_nbf_s*j_nbf_s
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H A D | intd_2e4c.F | 529 integer i_nbf_s,j_nbf_s,k_nbf_s,l_nbf_s local 570 j_nbf_s = int_nbf_s(Jt) 575 & j_nbf,i_nbf,j_nbf_s,i_nbf_s, 585 j_nbf = j_nbf_s
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/NWints/api/ |
H A D | int_1estv.F | 130 integer i_nbf_s, j_nbf_s 323 j_nbf_s = int_nbf_s(Lj) 342 j_nbf_s = j_nbf_x 360 j_nbf_s = int_nbf_s(Lj) 824 integer i_nbf_s, j_nbf_s 1031 j_nbf_s = int_nbf_s(Lj) 1050 j_nbf_s = j_nbf_x 1196 integer i_nbf_s, j_nbf_s 1436 j_nbf_s = j_nbf_x 1598 integer i_nbf_s, j_nbf_s [all …]
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H A D | intdd_1eh1.F | 156 integer i_nbf_s, j_nbf_s 246 j_nbf_s = int_nbf_s(Jtype) 253 & j_nbf_s,i_nbf_s,Itype,igen, 263 & j_nbf_s,i_nbf_s,Itype,igen, 273 j_nbf_s = j_nbf_x 279 & j_nbf_s,i_nbf_s,Itype,igen, 289 & j_nbf_s,i_nbf_s,Itype,igen, 299 j_nbf_s = int_nbf_s(Jtype) 305 & j_nbf_s,i_nbf_s,0,igen, 315 & j_nbf_s,i_nbf_s,0,igen, [all …]
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H A D | intdd_1eov.F | 151 integer i_nbf_s, j_nbf_s 254 j_nbf_s = int_nbf_s(Jtype) 261 & j_nbf_s,i_nbf_s,Itype,igen, 271 j_nbf_s = j_nbf_x 277 & j_nbf_s,i_nbf_s,Itype,igen, 287 j_nbf_s = int_nbf_s(Jtype) 293 & j_nbf_s,i_nbf_s,0,igen, 307 nint_s = i_nbf_s*j_nbf_s
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H A D | int_1epvpe.F | 66 integer i_nbf_s, j_nbf_s 181 j_nbf_s = int_nbf_s(Lj) 185 & j_nbf_s,i_nbf_s,Li,i_gen, 192 j_nbf_s = j_nbf_x 195 & j_nbf_s,i_nbf_s,Li,i_gen, 202 j_nbf_s = int_nbf_s(Lj) 205 & j_nbf_s,i_nbf_s,0,i_gen,
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H A D | int_1epxvpe.F | 67 integer i_nbf_s, j_nbf_s, icomp 150 j_nbf_s = int_nbf_s(Lj) 155 & j_nbf_s,i_nbf_s,Li,i_gen, 163 j_nbf_s = j_nbf_x 167 & j_nbf_s,i_nbf_s,Li,i_gen, 175 j_nbf_s = int_nbf_s(Lj) 179 & j_nbf_s,i_nbf_s,0,i_gen,
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H A D | int_vstat1e.F | 69 integer i_nbf_s, j_nbf_s local 166 j_nbf_s = int_nbf_s(Lj) 170 & j_nbf_s,i_nbf_s,Li,i_gen, 177 j_nbf_s = j_nbf_x 180 & j_nbf_s,i_nbf_s,Li,i_gen, 187 j_nbf_s = int_nbf_s(Lj) 190 & j_nbf_s,i_nbf_s,0,i_gen,
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H A D | intdd_1eecp1.F | 145 integer i_nbf_s, j_nbf_s local 252 j_nbf_s = int_nbf_s(Jtype) 259 & j_nbf_s,i_nbf_s,Itype,igen, 269 j_nbf_s = j_nbf_x 275 & j_nbf_s,i_nbf_s,Itype,igen, 285 j_nbf_s = int_nbf_s(Jtype) 291 & j_nbf_s,i_nbf_s,0,igen, 304 nint_s = i_nbf_s*j_nbf_s
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H A D | intd_1epot_cosmo.F | 194 integer i_nbf_s, j_nbf_s 491 j_nbf_s = int_nbf_s(Jtype) 497 & j_nbf_s,i_nbf_s,Itype,igen, 506 j_nbf_s = j_nbf_x 511 & j_nbf_s,i_nbf_s,Itype,igen, 520 j_nbf_s = int_nbf_s(Jtype) 525 & j_nbf_s,i_nbf_s,0,igen, 538 nint_s = i_nbf_s*j_nbf_s
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H A D | intd_1eke.F | 153 integer i_nbf_s, j_nbf_s 339 j_nbf_s = int_nbf_s(Jtype) 345 & j_nbf_s,i_nbf_s,Itype,igen, 354 j_nbf_s = j_nbf_x 359 & j_nbf_s,i_nbf_s,Itype,igen, 368 j_nbf_s = int_nbf_s(Jtype) 373 & j_nbf_s,i_nbf_s,0,igen, 386 nint_s = i_nbf_s*j_nbf_s
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H A D | intd_1eov.F | 158 integer i_nbf_s, j_nbf_s local 345 j_nbf_s = int_nbf_s(Jtype) 351 & j_nbf_s,i_nbf_s,Itype,igen, 360 j_nbf_s = j_nbf_x 365 & j_nbf_s,i_nbf_s,Itype,igen, 374 j_nbf_s = int_nbf_s(Jtype) 379 & j_nbf_s,i_nbf_s,0,igen, 392 nint_s = i_nbf_s*j_nbf_s
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H A D | intd_1eh1.F | 169 integer i_nbf_s, j_nbf_s 416 j_nbf_s = int_nbf_s(Jtype) 422 & j_nbf_s,i_nbf_s,Itype,igen, 431 j_nbf_s = j_nbf_x 436 & j_nbf_s,i_nbf_s,Itype,igen, 445 j_nbf_s = int_nbf_s(Jtype) 450 & j_nbf_s,i_nbf_s,0,igen, 463 nint_s = i_nbf_s*j_nbf_s
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H A D | intd_1epot.F | 167 integer i_nbf_s, j_nbf_s local 460 j_nbf_s = int_nbf_s(Jtype) 466 & j_nbf_s,i_nbf_s,Itype,igen, 475 j_nbf_s = j_nbf_x 480 & j_nbf_s,i_nbf_s,Itype,igen, 489 j_nbf_s = int_nbf_s(Jtype) 494 & j_nbf_s,i_nbf_s,0,igen, 507 nint_s = i_nbf_s*j_nbf_s
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