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/dports/science/ergo/ergo-3.8/source/integrals/
H A Dintegrals_1el_potential.cc1011 int boxIndex1, in get_nucl_repulsion_energy_using_multipoles() argument
1015 const atom_box_struct* currBox1 = &boxList[boxIndex1]; in get_nucl_repulsion_energy_using_multipoles()
1029 if(boxIndex1 == boxIndex2 && i1 == i2) in get_nucl_repulsion_energy_using_multipoles()
1031 if(boxIndex1 == boxIndex2 && i1 > i2) in get_nucl_repulsion_energy_using_multipoles()
1090 if(boxIndex1 == boxIndex2 && i1 > i2) in get_nucl_repulsion_energy_using_multipoles()
1219 int boxIndex1 = 0; in compute_V_and_gradient_linear() local
1227 boxIndex1, in compute_V_and_gradient_linear()
1489 int boxIndex1 = 0; in compute_V_hierarchical() local
1497 boxIndex1, in compute_V_hierarchical()