Searched refs:ritz_coeff (Results 1 – 2 of 2) sorted by relevance
128 ALLOCATE (ritz_coeff(nmo))135 ritz_coeff = 0.0_dp148 CALL cp_fm_get_diag(m_tmp, ritz_coeff)156 CALL cp_fm_column_scale(c_z, ritz_coeff)315 eig_not_conv(jj:jj + n - 1) = ritz_coeff(i_first:i_last)458 DEALLOCATE (ritz_coeff)525 ALLOCATE (ritz_coeff(nmo))550 ritz_coeff = 0.0_dp559 CALL dbcsr_get_diag(matrix_mm, ritz_coeff)560 CALL mp_sum(ritz_coeff, mo_coeff%matrix_struct%para_env%group)[all …]