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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/DMatrix/
H A DDMatrix.F200 jcur = jcur + 1
259 jcur = jcur + 1
315 jcur = jcur + 1
372 jcur = jcur + 1
425 jcur = jcur + 1
538 jcur = jcur + 1
592 jcur = jcur + 1
645 jcur = jcur + 1
682 jcur = jcur + 1
733 jcur = jcur + 1
[all …]
H A DDMatrix-mpi.F709 jcur = jcur + 1
868 jcur = jcur + 1
1012 jcur = jcur + 1
1174 jcur = jcur + 1
1317 jcur = jcur + 1
1885 jcur = jcur + 1
1923 jcur = jcur + 1
2165 jcur = jcur + 1
2367 jcur = jcur + 1
2562 jcur = jcur + 1
[all …]
H A DDMatrix-tcgmsg.F166 jcur = 0
215 jcur = jcur + 1
280 jcur = 0
344 jcur = jcur + 1
409 jcur = 0
473 jcur = jcur + 1
589 jcur = jcur + 1
1051 jcur = jcur + 1
1079 jcur = jcur + 1
1244 jcur = jcur + 1
[all …]
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/DMatrix/
H A DDMatrix.F200 jcur = jcur + 1
259 jcur = jcur + 1
315 jcur = jcur + 1
372 jcur = jcur + 1
425 jcur = jcur + 1
538 jcur = jcur + 1
592 jcur = jcur + 1
645 jcur = jcur + 1
682 jcur = jcur + 1
733 jcur = jcur + 1
[all …]
H A DDMatrix-mpi.F709 jcur = jcur + 1
868 jcur = jcur + 1
1012 jcur = jcur + 1
1174 jcur = jcur + 1
1317 jcur = jcur + 1
1860 jcur = jcur + 1
1896 jcur = jcur + 1
2138 jcur = jcur + 1
2340 jcur = jcur + 1
2535 jcur = jcur + 1
[all …]
H A DDMatrix-tcgmsg.F166 jcur = 0
215 jcur = jcur + 1
280 jcur = 0
344 jcur = jcur + 1
409 jcur = 0
473 jcur = jcur + 1
589 jcur = jcur + 1
1051 jcur = jcur + 1
1079 jcur = jcur + 1
1244 jcur = jcur + 1
[all …]
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/CMatrix/
H A DCMatrix.F190 jcur = jcur + 1
244 jcur = jcur + 1
299 jcur = jcur + 1
350 jcur = jcur + 1
461 jcur = jcur + 1
514 jcur = jcur + 1
567 jcur = jcur + 1
613 jcur = jcur + 1
672 jcur = jcur + 1
738 jcur = jcur + 1
[all …]
H A DCMatrix-mpi.F176 jcur = mod(jcur-1+np_j,np_j)
701 jcur = jcur + 1
861 jcur = jcur + 1
1003 jcur = jcur + 1
1149 jcur = jcur + 1
1291 jcur = jcur + 1
1842 jcur = jcur + 1
1880 jcur = jcur + 1
2117 jcur = jcur + 1
2311 jcur = jcur + 1
[all …]
H A DCMatrix-tcgmsg.F165 jcur = 0
214 jcur = jcur + 1
279 jcur = 0
343 jcur = jcur + 1
410 jcur = 0
458 jcur = jcur + 1
924 jcur = jcur + 1
952 jcur = jcur + 1
1067 jcur = 0
1117 jcur = jcur + 1
[all …]
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/CMatrix/
H A DCMatrix.F188 jcur = jcur + 1
242 jcur = jcur + 1
297 jcur = jcur + 1
348 jcur = jcur + 1
459 jcur = jcur + 1
512 jcur = jcur + 1
565 jcur = jcur + 1
611 jcur = jcur + 1
670 jcur = jcur + 1
736 jcur = jcur + 1
[all …]
H A DCMatrix-mpi.F132 jcur = mod(jcur-1+np_j,np_j)
151 jcur = mod(jcur-1+np_j,np_j)
171 jcur = mod(jcur-1+np_j,np_j)
185 jcur = mod(jcur-1+np_j,np_j)
684 jcur = jcur + 1
833 jcur = jcur + 1
969 jcur = jcur + 1
1515 jcur = jcur + 1
1551 jcur = jcur + 1
1788 jcur = jcur + 1
[all …]
H A DCMatrix-tcgmsg.F165 jcur = 0
214 jcur = jcur + 1
279 jcur = 0
343 jcur = jcur + 1
410 jcur = 0
458 jcur = jcur + 1
924 jcur = jcur + 1
952 jcur = jcur + 1
1067 jcur = 0
1117 jcur = jcur + 1
[all …]
/dports/science/mpqc/mpqc-2.3.1/src/lib/chemistry/qc/basis/
H A Dsymmint.cc53 while (OneBodyIntIter::ready() && !pl->lambda(icur,jcur)) in next()
61 while (OneBodyIntIter::ready() && !pl->lambda(icur,jcur)) in start()
68 return (double) pl->lambda(icur,jcur) / (double) pl->order(); in scale()
102 !pl->in_p4(i_offset(icur)+jcur, i_offset(kcur)+lcur, in next()
103 icur,jcur,kcur,lcur)) in next()
113 !pl->in_p4(i_offset(icur)+jcur, i_offset(kcur)+lcur, in start()
114 icur,jcur,kcur,lcur)) in start()
123 pl->in_p4(i_offset(icur)+jcur, i_offset(kcur)+lcur,icur,jcur,kcur,lcur); in scale()
H A Dtbint.cc392 jcur=0; j_ = jstart; in start()
421 if (jcur < jend-1) { in next()
422 jcur++; in next()
427 jcur=0; in next()
454 jcur++; in next()
459 jcur=0; in next()
486 jcur=0; in start()
512 if (jcur < icur) { // increment j loop? in next()
513 jcur++; in next()
518 jcur=0; in next()
[all …]
H A Dobint.h251 int jcur; variable
261 void start() { icur=jcur=index=0; } in start()
265 if (jcur < ((e12)?(icur):((jend)-1))) { in next()
267 jcur++; in next()
271 jcur=0; in next()
278 int current_j() const { return jcur; } in current_j()
281 int j() const { return jcur+joffset; } in j()
304 int jcur; variable
319 int jshell() const { return jcur; } in jshell()
H A Dobint.cc355 jcur=jstart; in start()
362 ij = (icur*(icur+1)>>1) + jcur; in start()
376 if (jcur < jlast) { in next()
377 jcur++; in next()
382 jcur=jstart; in next()
385 ij = (icur*(icur+1)>>1) + jcur; in next()
397 obi->compute_shell(icur,jcur); in current_pair()
398 spi.init(obi->buffer(), icur, jcur, in current_pair()
400 obi->basis2()->shell_to_function(jcur), in current_pair()
402 obi->basis2()->operator()(jcur).nfunction(), in current_pair()
/dports/misc/elki/elki-release0.7.1-1166-gfb1fffdf3/elki-clustering/src/main/java/de/lmu/ifi/dbs/elki/algorithm/clustering/kmeans/
H A DFastCLARANS.java230 final int jcur = assignment.intValue(j); in computeCostDifferential() local
232 cost[jcur] += Math.min(dist_h, second.doubleValue(j)) - distcur; in computeCostDifferential()
235 for(int mnum = 0; mnum < jcur; mnum++) { in computeCostDifferential()
238 for(int mnum = jcur + 1; mnum < k; mnum++) { in computeCostDifferential()
273 final int jcur = assignment.intValue(j); in performLastSwap() local
275 if(jcur == lastbest) { in performLastSwap()
283 secondid.putInt(j, jcur); in performLastSwap()
288 recompute(j, lastbest, dist_h, jcur, distsec); in performLastSwap()
298 secondid.putInt(j, jcur); in performLastSwap()
305 assignment.putInt(j, jcur); in performLastSwap()
[all …]
H A DCLARANS.java320 final int jcur = assignment.intValue(j); in computeCostDifferential() local
322 if(jcur == mnum) { in computeCostDifferential()
331 scratch.secondid.putInt(j, jcur); in computeCostDifferential()
338 scratch.recompute(j, mnum, dist_h, jcur, distsec); in computeCostDifferential()
349 scratch.secondid.putInt(j, jcur); in computeCostDifferential()
356 scratch.assignment.putInt(j, jcur); in computeCostDifferential()
362 scratch.recompute(j, jcur, distcur, mnum, dist_h); in computeCostDifferential()
/dports/devel/upp/upp/bazaar/plugin/sundials/src/sunnonlinsol/newton/
H A Dsunnonlinsol_newton.c87 content->jcur = SUNFALSE; in SUNNonlinSol_Newton()
152 NEWTON_CONTENT(NLS)->jcur = SUNFALSE; in SUNNonlinSolInitialize_Newton()
224 &(NEWTON_CONTENT(NLS)->jcur), in SUNNonlinSolSolve_Newton()
254 NEWTON_CONTENT(NLS)->jcur = SUNFALSE; in SUNNonlinSolSolve_Newton()
280 if ((retval > 0) && !(NEWTON_CONTENT(NLS)->jcur) && (NEWTON_CONTENT(NLS)->LSetup)) { in SUNNonlinSolSolve_Newton()
/dports/math/py-pystan/pystan-2.19.0.0/pystan/stan/lib/stan_math/lib/sundials_4.1.0/src/sunnonlinsol/newton/
H A Dsunnonlinsol_newton.c91 content->jcur = SUNFALSE; in SUNNonlinSol_Newton()
158 NEWTON_CONTENT(NLS)->jcur = SUNFALSE; in SUNNonlinSolInitialize_Newton()
222 &(NEWTON_CONTENT(NLS)->jcur), in SUNNonlinSolSolve_Newton()
254 NEWTON_CONTENT(NLS)->jcur = SUNFALSE; in SUNNonlinSolSolve_Newton()
280 if ((retval > 0) && !(NEWTON_CONTENT(NLS)->jcur) && (NEWTON_CONTENT(NLS)->LSetup)) { in SUNNonlinSolSolve_Newton()
/dports/science/cantera/cantera-2.5.1-611-gc4d6ecc15/ext/sundials/src/sunnonlinsol/newton/
H A Dsunnonlinsol_newton.c89 content->jcur = SUNFALSE; in SUNNonlinSol_Newton()
156 NEWTON_CONTENT(NLS)->jcur = SUNFALSE; in SUNNonlinSolInitialize_Newton()
228 &(NEWTON_CONTENT(NLS)->jcur), in SUNNonlinSolSolve_Newton()
279 NEWTON_CONTENT(NLS)->jcur = SUNFALSE; in SUNNonlinSolSolve_Newton()
305 if ((retval > 0) && !(NEWTON_CONTENT(NLS)->jcur) && (NEWTON_CONTENT(NLS)->LSetup)) { in SUNNonlinSolSolve_Newton()
/dports/math/stanmath/math-4.2.0/lib/sundials_5.7.0/src/sunnonlinsol/newton/
H A Dsunnonlinsol_newton.c89 content->jcur = SUNFALSE; in SUNNonlinSol_Newton()
156 NEWTON_CONTENT(NLS)->jcur = SUNFALSE; in SUNNonlinSolInitialize_Newton()
232 &(NEWTON_CONTENT(NLS)->jcur), in SUNNonlinSolSolve_Newton()
283 NEWTON_CONTENT(NLS)->jcur = SUNFALSE; in SUNNonlinSolSolve_Newton()
309 if ((retval > 0) && !(NEWTON_CONTENT(NLS)->jcur) && (NEWTON_CONTENT(NLS)->LSetup)) { in SUNNonlinSolSolve_Newton()
/dports/science/cantera/cantera-2.5.1-611-gc4d6ecc15/ext/sundials/src/arkode/
H A Darkode_arkstep_nls.c258 if (retval == ARK_SUCCESS) step_mem->jcur = SUNFALSE; in arkStep_Nls()
277 int arkStep_NlsLSetup(booleantype jbad, booleantype* jcur, void* arkode_mem) in arkStep_NlsLSetup() argument
297 &(step_mem->jcur), ark_mem->tempv1, in arkStep_NlsLSetup()
301 *jcur = step_mem->jcur; in arkStep_NlsLSetup()
H A Darkode_arkstep_impl.h110 booleantype jcur; /* is Jacobian info for lin solver current? */ member
174 realtype *gamrat, booleantype **jcur,
195 int arkStep_NlsLSetup(booleantype jbad, booleantype* jcur, void* arkode_mem);
/dports/math/sundials/sundials-5.7.0/src/sunnonlinsol/newton/
H A Dsunnonlinsol_newton.c89 content->jcur = SUNFALSE; in SUNNonlinSol_Newton()
156 NEWTON_CONTENT(NLS)->jcur = SUNFALSE; in SUNNonlinSolInitialize_Newton()
232 &(NEWTON_CONTENT(NLS)->jcur), in SUNNonlinSolSolve_Newton()
283 NEWTON_CONTENT(NLS)->jcur = SUNFALSE; in SUNNonlinSolSolve_Newton()
309 if ((retval > 0) && !(NEWTON_CONTENT(NLS)->jcur) && (NEWTON_CONTENT(NLS)->LSetup)) { in SUNNonlinSolSolve_Newton()

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