| .. | | 13-Oct-2020 | - |
| GNUmakefile | H A D | 13-Oct-2020 | 1.9 KiB | 46 | 29 |
| tddft_grad_anti_symmetrize.F | H A D | 13-Oct-2020 | 951 | 33 | 18 |
| tddft_grad_compute_dao.F | H A D | 13-Oct-2020 | 800 | 33 | 13 |
| tddft_grad_compute_energy.F | H A D | 13-Oct-2020 | 10.2 KiB | 295 | 162 |
| tddft_grad_compute_g.F | H A D | 13-Oct-2020 | 60.7 KiB | 1,403 | 1,003 |
| tddft_grad_compute_p.F | H A D | 13-Oct-2020 | 2.9 KiB | 114 | 55 |
| tddft_grad_compute_r.F | H A D | 13-Oct-2020 | 27.5 KiB | 742 | 421 |
| tddft_grad_compute_t.F | H A D | 13-Oct-2020 | 5.3 KiB | 166 | 109 |
| tddft_grad_compute_w.F | H A D | 13-Oct-2020 | 43.3 KiB | 1,205 | 889 |
| tddft_grad_dfxc.F | H A D | 13-Oct-2020 | 51.8 KiB | 1,101 | 735 |
| tddft_grad_dvxc.F | H A D | 13-Oct-2020 | 7.1 KiB | 185 | 95 |
| tddft_grad_dxcdmat.F | H A D | 13-Oct-2020 | 14.7 KiB | 352 | 200 |
| tddft_grad_e.F | H A D | 13-Oct-2020 | 1,016 | 42 | 19 |
| tddft_grad_epsilon.F | H A D | 13-Oct-2020 | 3.6 KiB | 103 | 68 |
| tddft_grad_finalize.F | H A D | 13-Oct-2020 | 1.5 KiB | 48 | 32 |
| tddft_grad_fix_exc.F | H A D | 13-Oct-2020 | 1.2 KiB | 43 | 12 |
| tddft_grad_fxc_l.F | H A D | 13-Oct-2020 | 9.2 KiB | 283 | 142 |
| tddft_grad_g.F | H A D | 13-Oct-2020 | 1.2 KiB | 57 | 23 |
| tddft_grad_get_dens.F | H A D | 13-Oct-2020 | 5.9 KiB | 150 | 96 |
| tddft_grad_grad_1e.F | H A D | 13-Oct-2020 | 7.9 KiB | 254 | 174 |
| tddft_grad_grad_2e.F | H A D | 13-Oct-2020 | 19.2 KiB | 459 | 329 |
| tddft_grad_gxc.F | H A D | 13-Oct-2020 | 7.3 KiB | 220 | 109 |
| tddft_grad_init.F | H A D | 13-Oct-2020 | 17.3 KiB | 464 | 348 |
| tddft_grad_init_func.F | H A D | 13-Oct-2020 | 3.4 KiB | 105 | 51 |
| tddft_grad_input.F | H A D | 13-Oct-2020 | 3.8 KiB | 123 | 66 |
| tddft_grad_ints.F | H A D | 13-Oct-2020 | 2 KiB | 74 | 38 |
| tddft_grad_irreg_acc.F | H A D | 13-Oct-2020 | 4.8 KiB | 173 | 88 |
| tddft_grad_load_mo.F | H A D | 13-Oct-2020 | 1.3 KiB | 51 | 23 |
| tddft_grad_load_xy.F | H A D | 13-Oct-2020 | 16.6 KiB | 480 | 341 |
| tddft_grad_make_2pdm.F | H A D | 13-Oct-2020 | 9.9 KiB | 278 | 138 |
| tddft_grad_mat_to_vec.F | H A D | 13-Oct-2020 | 4.8 KiB | 159 | 35 |
| tddft_grad_mo.F | H A D | 13-Oct-2020 | 1.3 KiB | 65 | 26 |
| tddft_grad_mpole.F | H A D | 13-Oct-2020 | 3.4 KiB | 109 | 70 |
| tddft_grad_print_array.F | H A D | 13-Oct-2020 | 5 KiB | 193 | 125 |
| tddft_grad_print_header.F | H A D | 13-Oct-2020 | 393 | 22 | 10 |
| tddft_grad_print_info.F | H A D | 13-Oct-2020 | 2 KiB | 70 | 51 |
| tddft_grad_print_result.F | H A D | 13-Oct-2020 | 2.3 KiB | 72 | 49 |
| tddft_grad_quadv0b.F | H A D | 13-Oct-2020 | 9.1 KiB | 237 | 131 |
| tddft_grad_r.F | H A D | 13-Oct-2020 | 1.9 KiB | 70 | 34 |
| tddft_grad_root_e.F | H A D | 13-Oct-2020 | 1,009 | 49 | 20 |
| tddft_grad_solve.F | H A D | 13-Oct-2020 | 9 KiB | 268 | 156 |
| tddft_grad_solve_common.fh | H A D | 13-Oct-2020 | 1.6 KiB | 36 | 35 |
| tddft_grad_solve_load_x.F | H A D | 13-Oct-2020 | 7.4 KiB | 201 | 151 |
| tddft_grad_solve_precond.F | H A D | 13-Oct-2020 | 4.5 KiB | 147 | 85 |
| tddft_grad_solve_product.F | H A D | 13-Oct-2020 | 5.2 KiB | 164 | 92 |
| tddft_grad_solve_save_x.F | H A D | 13-Oct-2020 | 8.2 KiB | 243 | 159 |
| tddft_grad_store_gradient.F | H A D | 13-Oct-2020 | 2.3 KiB | 83 | 47 |
| tddft_grad_tp.F | H A D | 13-Oct-2020 | 1.9 KiB | 71 | 35 |
| tddft_grad_trans_ao2mo.F | H A D | 13-Oct-2020 | 9 KiB | 288 | 195 |
| tddft_grad_trans_mo2ao.F | H A D | 13-Oct-2020 | 9.1 KiB | 289 | 195 |
| tddft_grad_util.fh | H A D | 13-Oct-2020 | 302 | 15 | 14 |
| tddft_grad_util_print.F | H A D | 13-Oct-2020 | 927 | 32 | 8 |
| tddft_grad_xy.F | H A D | 13-Oct-2020 | 3.5 KiB | 122 | 70 |
| tddft_gradient.F | H A D | 13-Oct-2020 | 19.7 KiB | 501 | 319 |