Home
last modified time | relevance | path

Searched refs:ef1_j (Results 1 – 6 of 6) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dewalds_multipole_sr.fypp380 ef1_j(1) = ef1_j(1) + tij_a(1) * ch_i
381 ef1_j(2) = ef1_j(2) + tij_a(2) * ch_i
382 ef1_j(3) = ef1_j(3) + tij_a(3) * ch_i
389 ef1_j(1) = ef1_j(1) - damptji_a(1) * ch_i
390 ef1_j(2) = ef1_j(2) - damptji_a(2) * ch_i
391 ef1_j(3) = ef1_j(3) - damptji_a(3) * ch_i
469 ef1_j(1) = ef1_j(1) + (tij_ab(1,1)*dp_i(1)+&
472 ef1_j(2) = ef1_j(2) + (tij_ab(1,2)*dp_i(1)+&
475 ef1_j(3) = ef1_j(3) + (tij_ab(1,3)*dp_i(1)+&
761 ef1_j(1) = ef1_j(1) + fac*(tij_abc(1,1,1)*qp_i(1,1)+&
[all …]
H A Dse_fock_matrix_integrals.F1099 REAL(KIND=dp), DIMENSION(3) :: dp_i, dp_j, ef1_i, ef1_j, fr, tij_a local
H A Dewalds_multipole.F386 dp_j, ef1_i, ef1_j, fr, rab, tij_a local
560 REAL(KIND=dp), DIMENSION(3) :: dp_i, dp_j, ef1_i, ef1_j, fr, rab, tij_a local
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dewalds_multipole_sr.fypp380 ef1_j(1) = ef1_j(1) + tij_a(1) * ch_i
381 ef1_j(2) = ef1_j(2) + tij_a(2) * ch_i
382 ef1_j(3) = ef1_j(3) + tij_a(3) * ch_i
389 ef1_j(1) = ef1_j(1) - damptji_a(1) * ch_i
390 ef1_j(2) = ef1_j(2) - damptji_a(2) * ch_i
391 ef1_j(3) = ef1_j(3) - damptji_a(3) * ch_i
469 ef1_j(1) = ef1_j(1) + (tij_ab(1,1)*dp_i(1)+&
472 ef1_j(2) = ef1_j(2) + (tij_ab(1,2)*dp_i(1)+&
475 ef1_j(3) = ef1_j(3) + (tij_ab(1,3)*dp_i(1)+&
761 ef1_j(1) = ef1_j(1) + fac*(tij_abc(1,1,1)*qp_i(1,1)+&
[all …]
H A Dse_fock_matrix_integrals.F1099 REAL(KIND=dp), DIMENSION(3) :: dp_i, dp_j, ef1_i, ef1_j, fr, tij_a local
H A Dewalds_multipole.F389 dp_j, ef1_i, ef1_j, fr, rab, tij_a local
563 REAL(KIND=dp), DIMENSION(3) :: dp_i, dp_j, ef1_i, ef1_j, fr, rab, tij_a local