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Searched refs:dr1_r2 (Results 1 – 4 of 4) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqs_cdft_methods.F164 dr, dr1_r2, dr_i_dR, dr_ij_dR, & local
390 … dr1_r2 = becke_control%vector_buffer%pair_dist_vecs(:, iatom, jatom)
392 dr1_r2 = (r - r1) - ANINT((r - r1)/cell_v)*cell_v
396 dr_ij_dR(:) = dr1_r2(:)/tmp_const
H A Dmixed_cdft_methods.F3568 dr, dr1_r2, dr_i_dR, dr_ij_dR, & local
3976 dr1_r2 = pair_dist_vecs(:, iatom, jatom)
3978 dr1_r2 = (r - r1) - ANINT((r - r1)/cell_v)*cell_v
3982 dr_ij_dR(:) = dr1_r2(:)/tmp_const
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqs_cdft_methods.F163 dr, dr1_r2, dr_i_dR, dr_ij_dR, & local
389 … dr1_r2 = becke_control%vector_buffer%pair_dist_vecs(:, iatom, jatom)
391 dr1_r2 = (r - r1) - ANINT((r - r1)/cell_v)*cell_v
395 dr_ij_dR(:) = dr1_r2(:)/tmp_const
H A Dmixed_cdft_methods.F3560 dr, dr1_r2, dr_i_dR, dr_ij_dR, & local
3968 dr1_r2 = pair_dist_vecs(:, iatom, jatom)
3970 dr1_r2 = (r - r1) - ANINT((r - r1)/cell_v)*cell_v
3974 dr_ij_dR(:) = dr1_r2(:)/tmp_const