/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | task_list_methods.F | 131 jpgf, jset, maxpgf, maxset, natoms, nimages, nkind, nseta, nsetb local 812 nimages, natom, maxset, maxpgf) argument 816 maxpgf local 859 nimages, natom, maxset, maxpgf) argument 910 nimages, natoms, maxset, maxpgf) argument 917 maxpgf local 1190 ntasks, nimages, natoms, maxset, maxpgf, create_list) argument 1484 maxpgf, tasks, use_reordered_ranks) argument 1489 maxset, maxpgf local 1882 SUBROUTINE distribute_tasks(rs_descs, ntasks, natoms, maxset, maxpgf, nimages, & argument [all …]
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H A D | lri_optimize_ri_basis_types.F | 151 INTEGER :: il, ipgf, iset, ishell, l, maxpgf, & local
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H A D | qs_integrate_potential_product.F | 153 jkind, jkind_old, jpgf, jpgf_new, jset, jset_new, jset_old, maxco, maxpgf, maxset, & local
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H A D | paw_proj_set_types.F | 248 isomin, jp, k, kp, lshell, lwork, lx, ly, lz, maxco, maxl, maxnprj, maxpgf, maxso, mp, & local
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H A D | auto_basis.F | 363 INTEGER :: i, iset, l, laux, lmax, lval, maxpgf, & local
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H A D | qs_collocate_density.F | 559 jset, lmax_global, m1, maxco, maxpgf, maxset, maxsgf, maxsgf_set, my_pos, na1, natom, & local 1442 lmax_global, maxco, maxpgf, maxset, maxsgf, maxsgf_set, my_der_type, my_idir, n, na1, & local 1995 jpgf, jset, jset_old, lmax_global, maxco, maxpgf, maxset, maxsgf, maxsgf_set, na1, na2, & local
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H A D | mp2_optimize_ri_basis.F | 1577 lshell, m, maxco, maxl, maxpgf, & local
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H A D | qs_linres_current.F | 589 jkind, jkind_old, jpgf, jset, jset_old, lmax_global, maxco, maxpgf, maxset, maxsgf, & local
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/aobasis/ |
H A D | aux_basis_set.F | 65 lshell, m, maxco, maxpgf, maxshell, & local
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H A D | soft_basis_set.F | 67 INTEGER :: ico, ipgf, ipgf_s, iset, iset_s, ishell, lshell, lshell_old, m, maxco, maxpgf, & local
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H A D | basis_set_types.F | 257 … INTEGER :: maxco, maxpgf, maxshell, ncgf, nset, nsgf local 509 INTEGER :: iset, ishell, lshell, maxco, maxpgf, & local 671 … last_cgf, last_sgf, n, gcc, maxco, maxl, maxpgf, maxsgf_set, maxshell, maxso, nco_sum, & argument 694 INTEGER, INTENT(OUT), OPTIONAL :: maxco, maxl, maxpgf, maxsgf_set, & local 1247 INTEGER :: i, ibasis, ico, ipgf, irep, iset, ishell, lshell, m, maxco, maxl, maxpgf, & local 1587 maxco, maxl, maxpgf, maxshell, ncgf, & local 2742 isgf_old, ishell, lshell, maxco, maxpgf, maxshell, mm, nc, ncgf, ns, nset local
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/dports/science/cp2k-data/cp2k-7.1.0/src/aobasis/ |
H A D | aux_basis_set.F | 65 lshell, m, maxco, maxpgf, maxshell, & local
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H A D | soft_basis_set.F | 67 INTEGER :: ico, ipgf, ipgf_s, iset, iset_s, ishell, lshell, lshell_old, m, maxco, maxpgf, & local
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H A D | basis_set_types.F | 252 … INTEGER :: maxco, maxpgf, maxshell, ncgf, nset, nsgf local 504 INTEGER :: iset, ishell, lshell, maxco, maxpgf, & local 666 … last_cgf, last_sgf, n, gcc, maxco, maxl, maxpgf, maxsgf_set, maxshell, maxso, nco_sum, & argument 689 INTEGER, INTENT(OUT), OPTIONAL :: maxco, maxl, maxpgf, maxsgf_set, & local 1244 maxpgf, maxshell, nbasis, ncgf, nmin, & local 1579 maxco, maxl, maxpgf, maxshell, ncgf, & local
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | lri_optimize_ri_basis_types.F | 151 INTEGER :: il, ipgf, iset, ishell, l, maxpgf, & local
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H A D | qs_integrate_potential_product.F | 202 jpgf, jpgf_new, jset, jset_new, jset_old, maxco, maxpgf, maxset, maxsgf_set, na1, na2, & local
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H A D | paw_proj_set_types.F | 248 isomin, jp, k, kp, lshell, lwork, lx, ly, lz, maxco, maxl, maxnprj, maxpgf, maxso, mp, & local
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H A D | auto_basis.F | 377 INTEGER :: i, iset, l, laux, lmax, lval, maxpgf, & local
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H A D | mp2_optimize_ri_basis.F | 1577 lshell, m, maxco, maxl, maxpgf, & local
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H A D | task_list_methods.F | 132 jset, maxpgf, maxset, natoms, nimages, nkind, nseta, nsetb, slot local
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H A D | qs_linres_current.F | 595 jatom_old, jkind, jkind_old, jpgf, jset, jset_old, maxco, maxpgf, maxset, maxsgf, & local
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/shg_int/ |
H A D | generic_shg_integrals_init.F | 54 … INTEGER :: ipgf, iset, ishell, l, maxpgf, maxshell, & local 268 INTEGER :: ipgf, iset, ishell, j, l, maxpgf, & local
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/dports/science/cp2k-data/cp2k-7.1.0/src/shg_int/ |
H A D | generic_shg_integrals_init.F | 54 … INTEGER :: ipgf, iset, ishell, l, maxpgf, maxshell, & local 268 INTEGER :: ipgf, iset, ishell, j, l, maxpgf, & local
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