/dports/science/siesta/siesta-4.1.5/Src/ |
H A D | ts_charge.F90 | 32 subroutine ts_charge_get(N_Elec,dit, sp, nspin, n_nzs, DM, S, Q, Qtot) argument 52 integer, intent(in) :: nspin, n_nzs local 137 nspin, n_nzs, DM, S, & argument 159 integer, intent(in) :: nspin, n_nzs local
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H A D | m_ts_sparse_helper.F90 | 126 integer, intent(in) :: n_nzs local 390 n_nzs, H, S, SpArrH, SpArrS, & argument 416 integer, intent(in) :: n_nzs local 651 n_nzs, A, A_UT) argument 672 integer, intent(in) :: n_nzs local 746 n_nzs, A, A_full) argument 767 integer, intent(in) :: n_nzs local 1067 integer :: n_nzs local 1081 integer :: n_nzs, d2 local 1120 integer :: n_nzs local [all …]
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H A D | ts_dq.F90 | 123 dit, sp, nspin, n_nzs, DM, EDM, S, Qtot) argument 144 integer, intent(in) :: nspin, n_nzs local 333 subroutine ts_dq_t_calculate_dEf(this, Qtot, dit, nspin, n_nzs, DM, S, dEf) argument 350 integer, intent(in) :: nspin, n_nzs local 605 subroutine ts_dq_scale_EDM_elec(N_Elec, Elecs, dit, sp, nspin, n_nzs, DM, EDM, & argument 626 integer, intent(in) :: nspin, n_nzs local
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H A D | m_test_io.F90 | 23 integer :: n_nzs, no_l, i local
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H A D | m_ts_dm_update.F90 | 477 subroutine update_DM(dit,sp,n_nzs,DM, spDM, Ef, & argument 491 integer, intent(in) :: n_nzs local 678 subroutine update_zDM(dit,sp,n_nzs,DM,spDM, Ef, & argument 687 integer, intent(in) :: n_nzs local 800 subroutine init_DM(dit,sp,n_nzs,DM,EDM, up_sp, Calc_Forces) argument 808 integer, intent(in) :: n_nzs local
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H A D | m_supercell.F90 | 58 integer :: ia, na_l, n_nzs local
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H A D | create_Sparsity_Union.F90 | 69 integer :: n_rows, n_rows_g, n_nzs local 271 integer :: n_rows, n_rows_g, n_nzs local
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H A D | m_ts_io.F90 | 19 subroutine ts_read_TSHS_opt(TSHS,DUMMY,na_u,no_u,no_s,nspin,n_nzs, & argument 38 integer, intent(out), optional :: na_u, no_u, no_s, nspin, n_nzs, lasto(:), kscell(3,3), nsc(3) local 382 subroutine ts_read_TSHS_opt_nc(TSHS,na_u,no_u,no_s,nspin,n_nzs, & argument 399 integer, intent(out), optional :: na_u, no_u, no_s, nspin, n_nzs, lasto(:), kscell(3,3), nsc(3) local 714 integer :: iu, version, no_s, n_s, n_nzs local 1265 integer :: iu, no_l, no_u, n_nzs local 1444 integer :: na_u, no_u, no_s, nspin, n_nzs, err local
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H A D | m_transiesta.F90 | 49 no_aux_cell, ucell, nsc, isc_off, no_u, na_u, lasto, xa, n_nzs, & argument 95 integer, intent(in) :: n_nzs local
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H A D | m_pivot.F90 | 67 integer :: n_nzs local
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H A D | m_sparsity_handling.F90 | 69 integer :: no_l, no_u, n_nzs local 172 integer :: no_l, no_u, n_nzs local 421 integer :: no_l, no_u, n_nzs local 560 integer :: no_l, no_u, n_nzs local 688 integer :: lio, io, no_l, no_u, n_nzs, n_nzsg, Bn, ind, lind local 951 integer :: io, i, j, n_nzs, sp_dim, dim2 local
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H A D | m_ncdf_io.F90 | 139 integer :: no_l, no_u, n_nzs, gio, io, ind, gind, max_n, j local 315 integer :: io, n_nzs, gind, ind, nl, n, i, nb, ib local 577 integer :: no_l, no_u, n_nzs, gio, io, ind, gind, max_n, j local 722 integer :: io, lno, no, gind, ind, n_nzs, n, i, nb, ib local 884 integer :: no_l, no_u, n_nzs, gio, io, ind, gind, max_n, j local 1097 integer :: io, lno, no, s, gind, ind, n_nzs, n, i, nb, ib local
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H A D | atom_graph.F90 | 111 integer :: ka, kna, ks, nna, nnkb, n_nzs local 467 integer :: na_l, lia, ia, n_nzs, ind, ja, j local
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H A D | m_io_s.F90 | 231 integer :: io, n_nzs, ind, nl, n, i, nb, ib local 659 integer :: io, lno, no, ind, n_nzs, n, i, nb, ib local 977 integer :: io, lno, no, s, ind, n_nzs, n, i, nb, ib local 1208 integer :: s, dim2, sp_dim, n_nzs, n, i local
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H A D | m_ts_mumpsk.F90 | 46 no_u, n_nzs, & argument 111 integer, intent(in) :: n_nzs local
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H A D | m_ts_mumpsg.F90 | 42 no_u, n_nzs, & argument 100 integer, intent(in) :: n_nzs local
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H A D | m_ts_trig.F90 | 47 no_u, n_nzs, & argument 115 integer, intent(in) :: n_nzs local
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H A D | m_ts_trik.F90 | 50 no_u, n_nzs, & argument 124 integer, intent(in) :: n_nzs local
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H A D | m_ts_fullg.F90 | 39 no_u, n_nzs, & argument 96 integer, intent(in) :: n_nzs local
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H A D | m_ts_fullk.F90 | 76 no_u, n_nzs, & argument 139 integer, intent(in) :: n_nzs local
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H A D | m_ncdf_siesta.F90 | 68 integer :: n_nzs, tmp, i, chks(3), iEl local
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/dports/science/siesta/siesta-4.1.5/Util/TS/TBtrans/ |
H A D | m_tbt_diag.F90 | 85 integer :: no, n_nzs, i, j, info local 172 integer :: i, j, n_nzs local 297 integer :: no, n_nzs, i, j, info local 393 integer :: i, j, n_nzs local
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H A D | m_tbt_sparse_helper.F90 | 60 n_nzs, H, S, sc_off, SpArrH, SpArrS, & argument 97 integer, intent(in) :: n_nzs local
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/dports/science/siesta/siesta-4.1.5/Util/TS/tshs2tshs/ |
H A D | tshs2tshs.f90 | 42 integer :: na_u, no_l, no_u, no_s, n_nzs, nspin, nsc(3) variable
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/dports/science/siesta/siesta-4.1.5/Util/SpPivot/ |
H A D | pvtsp.F90 | 68 integer :: n_nzs variable
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