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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dmanybody_eam.F58 INTEGER :: atom_a, atom_b, handle, i, i_a, i_b, & local
174 SUBROUTINE get_rho_eam(eam_a, eam_b, rab2, atom_a, atom_b, rho, fac) argument
177 INTEGER, INTENT(IN) :: atom_a, atom_b local
223 SUBROUTINE get_force_eam(rab2, eam_a, eam_b, eam_data, atom_a, atom_b, f_eam) argument
227 INTEGER, INTENT(IN) :: atom_a, atom_b local
H A Dfist_neighbor_list_types.F228 SUBROUTINE fist_neighbor_add(neighbor_kind_pair, atom_a, atom_b, & argument
232 INTEGER, INTENT(IN) :: atom_a, atom_b local
H A Dse_core_core.F85 INTEGER :: atom_a, atom_b, handle, iab, iatom, & local
H A Dse_fock_matrix_exchange.F86 INTEGER :: atom_a, atom_b, handle, iatom, icol, & local
H A Defield_tb_methods.F131 INTEGER :: atom_a, atom_b, blk, handle, ia, icol, & local
282 … INTEGER :: atom_a, atom_b, blk, handle, ia, iatom, & local
535 INTEGER :: atom_a, atom_b, blk, handle, i, ia, & local
H A Dqs_dftb_dispersion.F111 INTEGER :: atom_a, atom_b, handle, iatom, ikind, & local
H A Dmanybody_potential.F88 INTEGER :: atom_a, atom_b, handle, i, iend, ifirst, igrp, ikind, ilast, ilist, indexa, & local
361 INTEGER :: atom_a, atom_b, handle, i, i_a, i_b, iend, ifirst, igrp, ikind, ilast, ilist, & local
H A Dqs_gcp_method.F70 … INTEGER :: atom_a, atom_b, handle, i, iatom, ikind, & local
H A Dlri_forces.F172 INTEGER :: atom_a, atom_b, handle, i, iac, iatom, ic, ikind, ilist, ispin, jatom, jkind, & local
441 INTEGER :: atom_a, atom_b, handle, i, iac, iatom, ic, ikind, ilist, ispin, jatom, jkind, & local
759 INTEGER :: atom_a, atom_b, atom_c, handle, i, i1, & local
H A Dlri_ks_methods.F73 INTEGER :: atom_a, atom_b, col, handle, i, iac, iatom, ic, ikind, ilist, jatom, jkind, & local
H A Dfist_neighbor_lists.F294 INTEGER :: a_i, a_j, a_k, atom_a, atom_b, b_i, b_j, b_k, b_pi, b_pj, b_pk, bg_i, bg_j, bg_k, & local
654 INTEGER :: atom_a, atom_b, iab, ilist, mype, & local
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dmanybody_eam.F58 INTEGER :: atom_a, atom_b, handle, i, i_a, i_b, & local
174 SUBROUTINE get_rho_eam(eam_a, eam_b, rab2, atom_a, atom_b, rho, fac) argument
177 INTEGER, INTENT(IN) :: atom_a, atom_b local
223 SUBROUTINE get_force_eam(rab2, eam_a, eam_b, eam_data, atom_a, atom_b, f_eam) argument
227 INTEGER, INTENT(IN) :: atom_a, atom_b local
H A Dfist_neighbor_list_types.F228 SUBROUTINE fist_neighbor_add(neighbor_kind_pair, atom_a, atom_b, & argument
232 INTEGER, INTENT(IN) :: atom_a, atom_b local
H A Dse_core_core.F85 INTEGER :: atom_a, atom_b, handle, iab, iatom, & local
H A Dse_fock_matrix_exchange.F86 INTEGER :: atom_a, atom_b, handle, iatom, icol, & local
H A Defield_tb_methods.F131 INTEGER :: atom_a, atom_b, blk, handle, ia, icol, & local
282 … INTEGER :: atom_a, atom_b, blk, handle, ia, iatom, & local
534 INTEGER :: atom_a, atom_b, blk, handle, i, ia, & local
H A Dqs_dftb_dispersion.F111 INTEGER :: atom_a, atom_b, handle, iatom, ikind, & local
H A Dmanybody_potential.F88 INTEGER :: atom_a, atom_b, handle, i, iend, ifirst, igrp, ikind, ilast, ilist, indexa, & local
361 INTEGER :: atom_a, atom_b, handle, i, i_a, i_b, iend, ifirst, igrp, ikind, ilast, ilist, & local
H A Dqs_gcp_method.F70 … INTEGER :: atom_a, atom_b, handle, i, iatom, ikind, & local
H A Dlri_forces.F172 INTEGER :: atom_a, atom_b, handle, i, iac, iatom, ic, ikind, ilist, ispin, jatom, jkind, & local
441 INTEGER :: atom_a, atom_b, handle, i, iac, iatom, ic, ikind, ilist, ispin, jatom, jkind, & local
759 INTEGER :: atom_a, atom_b, atom_c, handle, i, i1, & local
H A Dlri_ks_methods.F73 INTEGER :: atom_a, atom_b, col, handle, i, iac, iatom, ic, ikind, ilist, jatom, jkind, & local
H A Dfist_neighbor_lists.F294 INTEGER :: a_i, a_j, a_k, atom_a, atom_b, b_i, b_j, b_k, b_pi, b_pj, b_pk, bg_i, bg_j, bg_k, & local
654 INTEGER :: atom_a, atom_b, iab, ilist, mype, & local
/dports/science/apbs/apbs-pdb2pqr-apbs-1.5-102-g500c1473/pdb2pqr/propka30/Source/
H A Dbonds.py388 def squared_distance(self, atom_a, atom_b): argument
/dports/science/votca/votca-2021.2-18560-gfbe18d971/xtp/xtp-2a31d70/src/libxtp/grids/
H A Dradial_euler_maclaurin_rule.cc129 const QMAtom& atom_b = atoms[j]; in RefineElementRangeMap() local
/dports/www/firefox-legacy/firefox-52.8.0esr/layout/tables/
H A DnsTableFrame.cpp129 nsTableFrame::GetParentStyleContext(nsIFrame** aProviderFrame) const

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