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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/pw/
H A Ddgs.F419 DO i = rhos%pw%pw_grid%bounds(1, 1), rhos%pw%pw_grid%bounds(2, 1)
432 DO i = rhos%pw%pw_grid%bounds(1, 2), rhos%pw%pw_grid%bounds(2, 2)
445 DO i = rhos%pw%pw_grid%bounds(1, 3), rhos%pw%pw_grid%bounds(2, 3)
460 CALL dg_add_patch(rs%r, rhos%pw%cr3d, rhos%pw%pw_grid%npts, &
466 CALL dg_add_patch(rs%r, rhos%pw%cr3d, rhos%pw%pw_grid%npts, nc)
721 DO i = rhos%pw%pw_grid%bounds(1, 1), rhos%pw%pw_grid%bounds(2, 1)
734 DO i = rhos%pw%pw_grid%bounds(1, 2), rhos%pw%pw_grid%bounds(2, 2)
747 DO i = rhos%pw%pw_grid%bounds(1, 3), rhos%pw%pw_grid%bounds(2, 3)
795 DO i = rhos%pw%pw_grid%bounds(1, 1), rhos%pw%pw_grid%bounds(2, 1)
808 DO i = rhos%pw%pw_grid%bounds(1, 2), rhos%pw%pw_grid%bounds(2, 2)
[all …]
/dports/science/cp2k-data/cp2k-7.1.0/src/pw/
H A Ddgs.F419 DO i = rhos%pw%pw_grid%bounds(1, 1), rhos%pw%pw_grid%bounds(2, 1)
432 DO i = rhos%pw%pw_grid%bounds(1, 2), rhos%pw%pw_grid%bounds(2, 2)
445 DO i = rhos%pw%pw_grid%bounds(1, 3), rhos%pw%pw_grid%bounds(2, 3)
460 CALL dg_add_patch(rs%r, rhos%pw%cr3d, rhos%pw%pw_grid%npts, &
466 CALL dg_add_patch(rs%r, rhos%pw%cr3d, rhos%pw%pw_grid%npts, nc)
721 DO i = rhos%pw%pw_grid%bounds(1, 1), rhos%pw%pw_grid%bounds(2, 1)
734 DO i = rhos%pw%pw_grid%bounds(1, 2), rhos%pw%pw_grid%bounds(2, 2)
747 DO i = rhos%pw%pw_grid%bounds(1, 3), rhos%pw%pw_grid%bounds(2, 3)
795 DO i = rhos%pw%pw_grid%bounds(1, 1), rhos%pw%pw_grid%bounds(2, 1)
808 DO i = rhos%pw%pw_grid%bounds(1, 2), rhos%pw%pw_grid%bounds(2, 2)
[all …]
/dports/math/blis/blis-0.8.1/kernels/bgq/1/
H A Dbli_dotv_bgq_int.c68 double rhos = 0.0; in bli_ddotv_bgq_int() local
69 #pragma omp parallel reduction(+:rhos) in bli_ddotv_bgq_int()
85 rhos += vec_extract( rhov, 0 ); in bli_ddotv_bgq_int()
86 rhos += vec_extract( rhov, 1 ); in bli_ddotv_bgq_int()
87 rhos += vec_extract( rhov, 2 ); in bli_ddotv_bgq_int()
88 rhos += vec_extract( rhov, 3 ); in bli_ddotv_bgq_int()
92 rhos += x[4*n_run + i] * y[4*n_run + i]; in bli_ddotv_bgq_int()
95 *rho = rhos; in bli_ddotv_bgq_int()
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dspme.F149 ALLOCATE (rhos(n, n, n))
182 CALL dg_sum_patch(rden, rhos, center(:, p1))
434 DEALLOCATE (rhos)
505 ALLOCATE (rhos(n, n, n))
524 CALL dg_sum_patch(rden, rhos, center(:, p1))
573 DEALLOCATE (rhos)
643 ALLOCATE (rhos(n, n, n))
731 DEALLOCATE (rhos)
780 nbox = SIZE(rhos, 1)
829 nbox = SIZE(rhos, 1)
[all …]
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dspme.F149 ALLOCATE (rhos(n, n, n))
182 CALL dg_sum_patch(rden, rhos, center(:, p1))
434 DEALLOCATE (rhos)
505 ALLOCATE (rhos(n, n, n))
524 CALL dg_sum_patch(rden, rhos, center(:, p1))
573 DEALLOCATE (rhos)
643 ALLOCATE (rhos(n, n, n))
731 DEALLOCATE (rhos)
780 nbox = SIZE(rhos, 1)
829 nbox = SIZE(rhos, 1)
[all …]
/dports/math/suitesparse-klu/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-config/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-graphblas/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-amd/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-ldl/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-rbio/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-mongoose/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-colamd/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-ccolamd/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-cholmod/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-spqr/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-umfpack/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-slip_lu/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-btf/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-camd/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-csparse/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/math/suitesparse-cxsparse/SuiteSparse-5.10.1/SLIP_LU/Source/
H A Dslip_forward_sub.c31 const SLIP_matrix *rhos // sequence of pivots used in factorization in slip_forward_sub() argument
42 SLIP_REQUIRE(rhos, SLIP_DENSE, SLIP_MPZ); in slip_forward_sub()
88 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
94 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
129 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
141 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
148 SLIP_1D(rhos, hx, mpz))); in slip_forward_sub()
154 SLIP_1D(rhos, i, mpz))); in slip_forward_sub()
165 SLIP_1D(rhos, i-1, mpz))); in slip_forward_sub()
/dports/science/quantum-espresso/q-e-qe-6.7.0/LAXlib/
H A Dla_helper.f90598 IF( SIZE(s,1) /= SIZE(rhos,1) .OR. SIZE(s,2) /= SIZE(rhos,2) ) &
608 s = rhos
651 aux( k ) = rhos( i, j )
655 CALL dspev_drv( 'V', 'L', n, aux, rhod, rhos, SIZE(rhos,1) )
706 s = rhos
707 lda = SIZE( rhos, 1 )
736 lwork_h = 1 + 6*SIZE(rhos,1) + 2*SIZE(rhos,1)*SIZE(rhos,1)
737 liwork_h = 3 + 5*SIZE(rhos,1)
740 ALLOCATE(a(SIZE(rhos,1),SIZE(rhos,2)),STAT = info)
754 info = cudaMemcpy(a, rhos, SIZE(rhos,1)*SIZE(rhos,2), cudaMemcpyDeviceToDevice)
[all …]
/dports/science/quantum-espresso/q-e-qe-6.7.0/CPV/src/
H A Druncp.f9050 REAL(DP) :: rhos(:,:) local
132 CALL tg_gather( dffts, rhos(:,i), tg_rhos(:,i) )
233 CALL dforce( i, bec_bgrp, vkb, c0_bgrp, c2, c3, rhos, &
243 CALL dforce_efield ( bec_bgrp, i, c0_bgrp, c2, c3, rhos)
247 CALL dforce_efield2 ( bec_bgrp, i, c0_bgrp, c2, c3, rhos)
327 REAL(DP) :: rhos(:,:) local
418 CALL dforce(i,bec,vkb,c0,c2,c3,rhos(:,1:1),SIZE(rhos,1),ispin,f,n,nspin)
419 CALL dforce(i,bec,vkb,c0,c4,c5,rhos(:,2:2),SIZE(rhos,1),ispin,f,n,nspin)
448 CALL dforce(npair,bec,vkb,c0,c2,c3,rhos(:,1:1),SIZE(rhos,1),ispin,f,n,nspin)
449 CALL dforce(npair,bec,vkb,c0,c4,c5,rhos(:,2:2),SIZE(rhos,1),ispin,f,n,nspin)
[all …]
/dports/lang/gcc6-aux/gcc-6-20180516/gcc/testsuite/gfortran.dg/graphite/
H A Dpr68692.f908 SUBROUTINE get_patch ( part, box, green, npts, p, rhos, is_core, is_shell,& argument
16 INTENT(OUT) :: rhos local
20 CALL spme_get_patch ( rhos, nbox, delta, q, coeff )
22 SUBROUTINE spme_get_patch ( rhos, n, delta, q, coeff ) argument
24 INTENT(OUT) :: rhos local
45 rhos ( i1, i2, i3 ) = r2 * f_assign ( 1, i1 )

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