Searched refs:enefunc (Results 1 – 2 of 2) sorted by relevance
355 funcT enefunc = copy(rho); in calculate_tot_xc_energy() local356 enefunc.scale(0.5); in calculate_tot_xc_energy()357 enefunc.unaryop(&::ldaeop); in calculate_tot_xc_energy()358 return enefunc.trace(); in calculate_tot_xc_energy()
905 Tensor<double> enefunc = copy(t); in dft_xc_lda_V() local907 ::xc_rks_generic_lda(t, enefunc, V); in dft_xc_lda_V()917 Tensor<double> enefunc = copy(t); in dft_xc_lda_ene() local918 ::xc_rks_generic_lda(t, enefunc, V); in dft_xc_lda_ene()919 t(___) = enefunc(___); in dft_xc_lda_ene()