/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | lri_environment_types.F | 633 nlist, nn, nneighbor local 662 nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, & 685 lri_ints%lri_atom(iac)%lri_node(ilist)%nnode = nneighbor 686 ALLOCATE (lri_ints%lri_atom(iac)%lri_node(ilist)%lri_int(nneighbor)) 854 nneighbor local 894 lri_ints_rho%lri_atom(iac)%lri_node(ilist)%nnode = nneighbor 895 ALLOCATE (lri_ints_rho%lri_atom(iac)%lri_node(ilist)%lri_int_rho(nneighbor)) 931 nlist, nn, nneighbor local 963 nnode=nneighbor, inode=jneighbor, r=rab) 979 lri_rho%lri_atom(iac)%lri_node(ilist)%nnode = nneighbor [all …]
|
H A D | commutator_rpnl.F | 78 nlist, nneighbor, nnode, np, nppnl, nprjc, nseta, nsgfa, nthread, prjc, sgfa local 181 … jatom=katom, nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, cell=cell_c, r=rac) 227 sap_int(iac)%alist(ilist)%nclist = nneighbor 228 ALLOCATE (sap_int(iac)%alist(ilist)%clist(nneighbor)) 229 DO i = 1, nneighbor
|
H A D | core_ppnl.F | 108 maxsgf, mepos, na, natom, nb, ncoa, ncoc, nkind, nlist, nneighbor, nnl, nnode, np, nppnl, & local 241 jatom=katom, nlist=nlist, ilist=ilist, nnode=nneighbor, & 303 sap_int(iac)%alist(ilist)%nclist = nneighbor 304 ALLOCATE (sap_int(iac)%alist(ilist)%clist(nneighbor)) 305 DO i = 1, nneighbor
|
H A D | lri_optimize_ri_basis.F | 200 nlist, nneighbor local 234 nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, & 669 ksgfb, lsgfb, mepos, nba, nbb, nfa, nfb, nkind, nlist, nn, nneighbor, nspin, nthread local 715 … jatom=jatom, nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor) 843 nfa, nfb, nkind, nlist, nn, nneighbor, & local 874 … jatom=jatom, nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor)
|
H A D | fist_neighbor_lists.F | 655 nneighbor local 670 nneighbor = 0 676 nneighbor = nneighbor + 1 715 nneighbor
|
H A D | qs_dftb_coulomb.F | 620 n1, n2, natorb_a, natorb_b, ngrd, ngrdcut, nkind, nlist, nneighbor local 664 jatom=jatom, nlist=nlist, ilist=ilist, nnode=nneighbor, & 693 sap_int(iac)%alist(ilist)%nclist = nneighbor 694 ALLOCATE (sap_int(iac)%alist(ilist)%clist(nneighbor)) 695 DO i = 1, nneighbor
|
H A D | qs_oce_methods.F | 367 ncoa_sum, nkind, nlist, nneighbor, nsatbas, nseta, nsetb, nsgf_cnt, nsgfa, nsobtot local 429 … nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, cell=cell_b, r=rab) 488 intac(iac)%alist(ilist)%nclist = nneighbor 489 ALLOCATE (intac(iac)%alist(ilist)%clist(nneighbor))
|
H A D | lri_environment_methods.F | 138 nfa, nfb, nkind, nlist, nn, nneighbor, & local 199 nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, & 495 nlist, nneighbor local 529 nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, & 613 nba, nbb, nfa, nfb, nkind, nlist, nn, nneighbor, nspin, nthread local 661 … jatom=jatom, nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, &
|
H A D | xtb_coulomb.F | 818 n1, n2, natorb_a, natorb_b, ncoa, ncob, nkind, nlist, nneighbor, nseta, nsetb, sgfa, sgfb local 864 jatom=jatom, nlist=nlist, ilist=ilist, nnode=nneighbor, & 891 sap_int(iac)%alist(ilist)%nclist = nneighbor 892 ALLOCATE (sap_int(iac)%alist(ilist)%clist(nneighbor)) 893 DO i = 1, nneighbor
|
H A D | qs_neighbor_lists.F | 1703 nneighbor, nnode local 1735 nneighbor = 0 1741 nneighbor = nneighbor + 1 1759 nneighbor
|
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | lri_environment_types.F | 618 nlist, nn, nneighbor local 647 nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, & 670 lri_ints%lri_atom(iac)%lri_node(ilist)%nnode = nneighbor 671 ALLOCATE (lri_ints%lri_atom(iac)%lri_node(ilist)%lri_int(nneighbor)) 839 nneighbor local 879 lri_ints_rho%lri_atom(iac)%lri_node(ilist)%nnode = nneighbor 880 ALLOCATE (lri_ints_rho%lri_atom(iac)%lri_node(ilist)%lri_int_rho(nneighbor)) 916 nlist, nn, nneighbor local 948 nnode=nneighbor, inode=jneighbor, r=rab) 964 lri_rho%lri_atom(iac)%lri_node(ilist)%nnode = nneighbor [all …]
|
H A D | sap_kind_types.F | 290 maxsgf, na, nb, ncoa, ncoc, nkind, nlist, nneighbor, nnl, np, nppnl, nprjc, nseta, nsgfa, & local 377 nneighbor = sap_ppnl(1)%nlist_task(slot)%nnode 396 sap_int(iac)%alist(ilist)%nclist = nneighbor 397 ALLOCATE (sap_int(iac)%alist(ilist)%clist(nneighbor)) 398 DO i = 1, nneighbor 432 nneighbor = sap_ppnl(1)%nlist_task(slot)%nnode
|
H A D | core_ppnl.F | 106 ncoa, ncoc, nkind, nlist, nneighbor, nnl, np, nppnl, nprjc, nseta, nsgfa, prjc, sgfa, slot local 225 nneighbor = sap_ppnl(1)%nlist_task(slot)%nnode 244 sap_int(iac)%alist(ilist)%nclist = nneighbor 245 ALLOCATE (sap_int(iac)%alist(ilist)%clist(nneighbor)) 246 DO i = 1, nneighbor 279 nneighbor = sap_ppnl(1)%nlist_task(slot)%nnode
|
H A D | lri_optimize_ri_basis.F | 200 nlist, nneighbor local 234 nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, & 669 ksgfb, lsgfb, mepos, nba, nbb, nfa, nfb, nkind, nlist, nn, nneighbor, nspin, nthread local 715 … jatom=jatom, nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor) 843 nfa, nfb, nkind, nlist, nn, nneighbor, & local 874 … jatom=jatom, nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor)
|
H A D | fist_neighbor_lists.F | 655 nneighbor local 670 nneighbor = 0 676 nneighbor = nneighbor + 1 715 nneighbor
|
H A D | qs_dftb_coulomb.F | 620 n1, n2, natorb_a, natorb_b, ngrd, ngrdcut, nkind, nlist, nneighbor local 664 jatom=jatom, nlist=nlist, ilist=ilist, nnode=nneighbor, & 693 sap_int(iac)%alist(ilist)%nclist = nneighbor 694 ALLOCATE (sap_int(iac)%alist(ilist)%clist(nneighbor)) 695 DO i = 1, nneighbor
|
H A D | commutator_rpnl.F | 85 nlist, nneighbor, nnode, np, nppnl, nprjc, nseta, nsgfa, nthread, prjc, sgfa local 188 … jatom=katom, nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, cell=cell_c, r=rac) 234 sap_int(iac)%alist(ilist)%nclist = nneighbor 235 ALLOCATE (sap_int(iac)%alist(ilist)%clist(nneighbor)) 236 DO i = 1, nneighbor
|
H A D | qs_oce_methods.F | 372 ncoa_sum, nkind, nlist, nneighbor, nsatbas, nseta, nsetb, nsgf_cnt, nsgfa, nsobtot, slot local 426 nneighbor = sap_oce(1)%nlist_task(slot)%nnode 452 intac(iac)%alist(ilist)%nclist = nneighbor 453 ALLOCATE (intac(iac)%alist(ilist)%clist(nneighbor))
|
H A D | lri_environment_methods.F | 138 nfa, nfb, nkind, nlist, nn, nneighbor, & local 199 nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, & 495 nlist, nneighbor local 529 nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, & 613 nba, nbb, nfa, nfb, nkind, nlist, nn, nneighbor, nspin, nthread local 661 … jatom=jatom, nlist=nlist, ilist=ilist, nnode=nneighbor, inode=jneighbor, &
|
H A D | xtb_coulomb.F | 818 n1, n2, natorb_a, natorb_b, ncoa, ncob, nkind, nlist, nneighbor, nseta, nsetb, sgfa, sgfb local 864 jatom=jatom, nlist=nlist, ilist=ilist, nnode=nneighbor, & 891 sap_int(iac)%alist(ilist)%nclist = nneighbor 892 ALLOCATE (sap_int(iac)%alist(ilist)%clist(nneighbor)) 893 DO i = 1, nneighbor
|
H A D | qs_neighbor_lists.F | 1737 nneighbor, nnode local 1769 nneighbor = 0 1775 nneighbor = nneighbor + 1 1793 nneighbor
|
/dports/graphics/graphviz/graphviz-2.44.1/lib/mingle/ |
H A D | agglomerative_bundling.h | 32 pedge* agglomerative_ink_bundling(int dim, SparseMatrix A, pedge* edges, int nneighbor, int max_rec…
|
H A D | edge_bundling.h | 27 …rseMatrix A, int dim, real *x, int maxit_outer, real K, int method, int nneighbor, int compatibili…
|
H A D | agglomerative_bundling.c | 762 pedge* agglomerative_ink_bundling(int dim, SparseMatrix A, pedge* edges, int nneighbor, int MAX_REC… in agglomerative_ink_bundling() argument 768 …edges2 = agglomerative_ink_bundling_internal(dim, A, edges, nneighbor, &recurse_level, MAX_RECURSE… in agglomerative_ink_bundling()
|
H A D | edge_bundling.c | 753 …seMatrix A0, int dim, real *x, int maxit_outer, real K, int method, int nneighbor, int compatibili… in edge_bundling() argument 801 …edges = agglomerative_ink_bundling(dim, A, edges, nneighbor, max_recursion, angle_param, angle, op… in edge_bundling()
|