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Searched refs:norm_scalar (Results 1 – 18 of 18) sorted by relevance

/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dmao_optimizer.F144 CALL dbcsr_norm(mao_grad(ispin)%matrix, dbcsr_norm_maxabsnorm, norm_scalar=grad_norm)
158 CALL dbcsr_norm(mao_grad(ispin)%matrix, dbcsr_norm_maxabsnorm, norm_scalar=grad_norm)
H A Diterate_matrix.F201 dbcsr_norm_maxabsnorm, norm_scalar=maxnorm)
377 dbcsr_norm_maxabsnorm, norm_scalar=maxnorm_matrix)
403 CALL dbcsr_norm(tmp1, dbcsr_norm_maxabsnorm, norm_scalar=maxnorm_matrix)
582 dbcsr_norm_maxabsnorm, norm_scalar=maxnorm_matrix)
1574 REAL(dp) :: factorial, norm_C, norm_D, norm_scalar local
1588 norm_scalar = ABS(alpha)*dbcsr_frobenius_norm(matrix)
1593 IF ((norm_scalar/2.0_dp**k) <= one) EXIT
H A Dalmo_scf_optimizer.F213 norm_scalar=error_norm_ispin)
568 norm_scalar=error_norm)
1422 norm_scalar=grad_norm_spin(ispin))
5069 norm_scalar=penalty_occ_vol_g_norm)
5071 norm_scalar=energy_g_norm)
5432 dbcsr_norm_maxabsnorm, norm_scalar=t_norm)
6337 norm_scalar=residue_max_norm(ispin))
6486 norm_scalar=alpha)
6490 norm_scalar=alpha)
6493 norm_scalar=alpha)
[all …]
H A Dct_methods.F868 CALL dbcsr_norm(res, dbcsr_norm_maxabsnorm, norm_scalar=best_norm)
1123 CALL dbcsr_norm(res_trial, dbcsr_norm_maxabsnorm, norm_scalar=obj_function)
H A Ddm_ls_scf_curvy.F390 CALL dbcsr_norm(matrix_res, which_norm=2, norm_scalar=old_conv)
H A Dcp_dbcsr_operations.F795 norm_scalar=norm)
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dmao_optimizer.F144 CALL dbcsr_norm(mao_grad(ispin)%matrix, dbcsr_norm_maxabsnorm, norm_scalar=grad_norm)
158 CALL dbcsr_norm(mao_grad(ispin)%matrix, dbcsr_norm_maxabsnorm, norm_scalar=grad_norm)
H A Diterate_matrix.F208 dbcsr_norm_maxabsnorm, norm_scalar=maxnorm)
384 dbcsr_norm_maxabsnorm, norm_scalar=maxnorm_matrix)
410 CALL dbcsr_norm(tmp1, dbcsr_norm_maxabsnorm, norm_scalar=maxnorm_matrix)
589 dbcsr_norm_maxabsnorm, norm_scalar=maxnorm_matrix)
1828 REAL(dp) :: factorial, norm_C, norm_D, norm_scalar local
1842 norm_scalar = ABS(alpha)*dbcsr_frobenius_norm(matrix)
1847 IF ((norm_scalar/2.0_dp**k) <= one) EXIT
H A Dalmo_scf_optimizer.F228 norm_scalar=error_norm_ispin)
583 norm_scalar=error_norm)
1490 norm_scalar=grad_norm_spin(ispin))
2520 norm_scalar=grad_norm_spin(ispin))
6166 norm_scalar=penalty_occ_vol_g_norm)
6168 norm_scalar=energy_g_norm)
7922 norm_scalar=alpha)
7926 norm_scalar=alpha)
7929 norm_scalar=alpha)
9033 norm_scalar=test_error)
[all …]
H A Dct_methods.F868 CALL dbcsr_norm(res, dbcsr_norm_maxabsnorm, norm_scalar=best_norm)
1123 CALL dbcsr_norm(res_trial, dbcsr_norm_maxabsnorm, norm_scalar=obj_function)
H A Ddm_ls_scf_curvy.F390 CALL dbcsr_norm(matrix_res, which_norm=2, norm_scalar=old_conv)
H A Dcp_dbcsr_operations.F789 norm_scalar=norm)
/dports/math/dbcsr/dbcsr-2.1.0/tests/
H A Ddbcsr_test_csr_conversions.F167 CALL dbcsr_norm(dbcsr_mat_conv, dbcsr_norm_maxabsnorm, norm_scalar=norm)
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/tests/
H A Ddbcsr_test_csr_conversions.F167 CALL dbcsr_norm(dbcsr_mat_conv, dbcsr_norm_maxabsnorm, norm_scalar=norm)
/dports/math/dbcsr/dbcsr-2.1.0/src/
H A Ddbcsr_api.F723 SUBROUTINE dbcsr_norm_scalar(matrix, which_norm, norm_scalar) argument
727 REAL(dp), INTENT(OUT) :: norm_scalar local
729 CALL dbcsr_norm_scalar_prv(matrix%prv, which_norm, norm_scalar)
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/src/
H A Ddbcsr_api.F728 SUBROUTINE dbcsr_norm_scalar(matrix, which_norm, norm_scalar) argument
732 REAL(dp), INTENT(OUT) :: norm_scalar local
734 CALL dbcsr_norm_scalar_prv(matrix%prv, which_norm, norm_scalar)
/dports/math/dbcsr/dbcsr-2.1.0/src/ops/
H A Ddbcsr_operations.F2019 SUBROUTINE dbcsr_norm_scalar(matrix, which_norm, norm_scalar) argument
2025 REAL(KIND=real_8), INTENT(OUT) :: norm_scalar local
2037 norm_scalar = dbcsr_frobenius_norm(matrix)
2039 norm_scalar = dbcsr_maxabs(matrix)
2041 norm_scalar = dbcsr_gershgorin_norm(matrix)
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/src/ops/
H A Ddbcsr_operations.F2038 SUBROUTINE dbcsr_norm_scalar(matrix, which_norm, norm_scalar) argument
2044 REAL(KIND=real_8), INTENT(OUT) :: norm_scalar local
2057 norm_scalar = dbcsr_frobenius_norm(matrix)
2059 norm_scalar = dbcsr_maxabs(matrix)
2061 norm_scalar = dbcsr_gershgorin_norm(matrix)