|
Name |
|
Date |
Size |
#Lines |
LOC |
| .. | | 13-Oct-2020 | - |
| 2ndDerivB97.c | H A D | 13-Oct-2020 | 22.4 KiB | 707 | 483 |
| 2ndDerivB97.h | H A D | 13-Oct-2020 | 915 | 55 | 40 |
| Files | H A D | 13-Oct-2020 | 1.3 KiB | 64 | 36 |
| GNUmakefile | H A D | 13-Oct-2020 | 2.1 KiB | 80 | 67 |
| a_dist.F | H A D | 13-Oct-2020 | 1.5 KiB | 62 | 41 |
| chk_dens.F | H A D | 13-Oct-2020 | 737 | 36 | 19 |
| eumac.F | H A D | 13-Oct-2020 | 757 | 36 | 19 |
| hse08fx.F | H A D | 13-Oct-2020 | 50.2 KiB | 1,314 | 982 |
| localize_sic.F | H A D | 13-Oct-2020 | 5.7 KiB | 167 | 115 |
| qdist.F | H A D | 13-Oct-2020 | 964 | 41 | 23 |
| scat_mat.F | H A D | 13-Oct-2020 | 2.7 KiB | 142 | 88 |
| setACmat.F | H A D | 13-Oct-2020 | 10.6 KiB | 319 | 158 |
| steric_energy.F | H A D | 13-Oct-2020 | 2.9 KiB | 113 | 57 |
| ts_eval_fnl.F | H A D | 13-Oct-2020 | 5.3 KiB | 166 | 58 |
| ts_pc.F | H A D | 13-Oct-2020 | 4.7 KiB | 158 | 93 |
| ts_tf.F | H A D | 13-Oct-2020 | 5.4 KiB | 158 | 51 |
| ts_vw.F | H A D | 13-Oct-2020 | 6.6 KiB | 198 | 78 |
| xc.fh | H A D | 13-Oct-2020 | 94 | 7 | 6 |
| xc_3rd_deriv.F | H A D | 13-Oct-2020 | 41.1 KiB | 893 | 562 |
| xc_atomblock.F | H A D | 13-Oct-2020 | 2.3 KiB | 84 | 57 |
| xc_att_xc.F | H A D | 13-Oct-2020 | 13.3 KiB | 414 | 205 |
| xc_bc95.F | H A D | 13-Oct-2020 | 9.2 KiB | 345 | 219 |
| xc_becke88.F | H A D | 13-Oct-2020 | 14.2 KiB | 410 | 262 |
| xc_bnl.F | H A D | 13-Oct-2020 | 17.7 KiB | 602 | 334 |
| xc_cMpbe96.F | H A D | 13-Oct-2020 | 10.5 KiB | 334 | 172 |
| xc_camb88.F | H A D | 13-Oct-2020 | 16.2 KiB | 495 | 316 |
| xc_cams12x.F | H A D | 13-Oct-2020 | 10.7 KiB | 370 | 233 |
| xc_camxlsd.F | H A D | 13-Oct-2020 | 7.2 KiB | 250 | 136 |
| xc_camxpbe96.F | H A D | 13-Oct-2020 | 21.7 KiB | 670 | 468 |
| xc_chkdispauto.F | H A D | 13-Oct-2020 | 747 | 31 | 17 |
| xc_cm05.F | H A D | 13-Oct-2020 | 23.6 KiB | 853 | 577 |
| xc_cm06.F | H A D | 13-Oct-2020 | 12.9 KiB | 462 | 318 |
| xc_cm11.F | H A D | 13-Oct-2020 | 15.9 KiB | 496 | 373 |
| xc_cpkzb99.F | H A D | 13-Oct-2020 | 13.6 KiB | 473 | 296 |
| xc_cs00.F | H A D | 13-Oct-2020 | 3.4 KiB | 142 | 81 |
| xc_cscan.F | H A D | 13-Oct-2020 | 12.6 KiB | 401 | 275 |
| xc_cscanl.F | H A D | 13-Oct-2020 | 12.9 KiB | 405 | 279 |
| xc_csogga.F | H A D | 13-Oct-2020 | 10.7 KiB | 328 | 245 |
| xc_ctpss03.F | H A D | 13-Oct-2020 | 21.8 KiB | 709 | 487 |
| xc_cvs98.F | H A D | 13-Oct-2020 | 13.6 KiB | 481 | 334 |
| xc_dirac.F | H A D | 13-Oct-2020 | 5.7 KiB | 188 | 81 |
| xc_dirac_screened.F | H A D | 13-Oct-2020 | 5.6 KiB | 208 | 129 |
| xc_eval_basis.F | H A D | 13-Oct-2020 | 114.4 KiB | 2,578 | 2,096 |
| xc_eval_fnl.F | H A D | 13-Oct-2020 | 61.2 KiB | 1,853 | 1,315 |
| xc_exact_pot.F | H A D | 13-Oct-2020 | 9.3 KiB | 262 | 217 |
| xc_exso.F | H A D | 13-Oct-2020 | 9.9 KiB | 282 | 200 |
| xc_fd.F | H A D | 13-Oct-2020 | 10.6 KiB | 343 | 242 |
| xc_fitv.F | H A D | 13-Oct-2020 | 9.7 KiB | 293 | 169 |
| xc_ft97.F | H A D | 13-Oct-2020 | 43.2 KiB | 1,046 | 587 |
| xc_getv.F | H A D | 13-Oct-2020 | 18.2 KiB | 476 | 231 |
| xc_getvxc.F | H A D | 13-Oct-2020 | 8.3 KiB | 229 | 106 |
| xc_gill96.F | H A D | 13-Oct-2020 | 7.8 KiB | 252 | 154 |
| xc_hcth.F | H A D | 13-Oct-2020 | 47.2 KiB | 1,400 | 798 |
| xc_hcth.fh | H A D | 13-Oct-2020 | 7.1 KiB | 155 | 149 |
| xc_hfexch.F | H A D | 13-Oct-2020 | 463 | 22 | 10 |
| xc_kop.F | H A D | 13-Oct-2020 | 1.9 KiB | 86 | 64 |
| xc_kt1.F | H A D | 13-Oct-2020 | 6.7 KiB | 229 | 107 |
| xc_lb94.F | H A D | 13-Oct-2020 | 6.3 KiB | 233 | 124 |
| xc_lebedev.F | H A D | 13-Oct-2020 | 169.1 KiB | 4,174 | 4,023 |
| xc_lyp88.F | H A D | 13-Oct-2020 | 41 KiB | 1,062 | 657 |
| xc_murakn.F | H A D | 13-Oct-2020 | 1.5 KiB | 58 | 24 |
| xc_oep.F | H A D | 13-Oct-2020 | 2.6 KiB | 83 | 78 |
| xc_op.F | H A D | 13-Oct-2020 | 7.6 KiB | 268 | 182 |
| xc_optc.F | H A D | 13-Oct-2020 | 4 KiB | 137 | 78 |
| xc_optx.F | H A D | 13-Oct-2020 | 4 KiB | 161 | 93 |
| xc_params.fh | H A D | 13-Oct-2020 | 100 | 7 | 6 |
| xc_pbe96.F | H A D | 13-Oct-2020 | 80.4 KiB | 1,945 | 1,495 |
| xc_perdew86.F | H A D | 13-Oct-2020 | 30.5 KiB | 823 | 560 |
| xc_perdew91.F | H A D | 13-Oct-2020 | 42 KiB | 1,069 | 781 |
| xc_pw91lda.F | H A D | 13-Oct-2020 | 15.5 KiB | 441 | 292 |
| xc_pw91ldag.F | H A D | 13-Oct-2020 | 2.2 KiB | 83 | 47 |
| xc_replicated.F | H A D | 13-Oct-2020 | 14.1 KiB | 469 | 355 |
| xc_rhogen.F | H A D | 13-Oct-2020 | 44.4 KiB | 1,283 | 973 |
| xc_s12x.F | H A D | 13-Oct-2020 | 9.9 KiB | 319 | 184 |
| xc_sic.F | H A D | 13-Oct-2020 | 15.3 KiB | 393 | 329 |
| xc_sic_pert.F | H A D | 13-Oct-2020 | 6.7 KiB | 179 | 143 |
| xc_sicutil.F | H A D | 13-Oct-2020 | 2.2 KiB | 71 | 56 |
| xc_signf.F | H A D | 13-Oct-2020 | 3.4 KiB | 115 | 77 |
| xc_spbe96.F | H A D | 13-Oct-2020 | 27.4 KiB | 745 | 524 |
| xc_ssbD_1.F | H A D | 13-Oct-2020 | 7.8 KiB | 265 | 163 |
| xc_tabcd.F | H A D | 13-Oct-2020 | 25.9 KiB | 685 | 440 |
| xc_tarad.F | H A D | 13-Oct-2020 | 4.5 KiB | 154 | 106 |
| xc_util.F | H A D | 13-Oct-2020 | 18 KiB | 579 | 419 |
| xc_vdw.fh | H A D | 13-Oct-2020 | 698 | 22 | 21 |
| xc_vdw_init.F | H A D | 13-Oct-2020 | 2.4 MiB | 36,717 | 36,611 |
| xc_vdw_main.F | H A D | 13-Oct-2020 | 33.6 KiB | 1,014 | 677 |
| xc_vdw_util.F | H A D | 13-Oct-2020 | 30.5 KiB | 1,013 | 592 |
| xc_vwn_1.F | H A D | 13-Oct-2020 | 1.2 KiB | 45 | 10 |
| xc_vwn_1_rpa.F | H A D | 13-Oct-2020 | 1.2 KiB | 45 | 10 |
| xc_vwn_2.F | H A D | 13-Oct-2020 | 1.5 KiB | 48 | 13 |
| xc_vwn_3.F | H A D | 13-Oct-2020 | 3.2 KiB | 79 | 44 |
| xc_vwn_4.F | H A D | 13-Oct-2020 | 1.2 KiB | 45 | 10 |
| xc_vwn_5.F | H A D | 13-Oct-2020 | 1.3 KiB | 47 | 10 |
| xc_xb86b.F | H A D | 13-Oct-2020 | 8 KiB | 252 | 153 |
| xc_xdm.F | H A D | 13-Oct-2020 | 44.5 KiB | 995 | 851 |
| xc_xm05.F | H A D | 13-Oct-2020 | 22.8 KiB | 778 | 514 |
| xc_xm06.F | H A D | 13-Oct-2020 | 14.1 KiB | 481 | 337 |
| xc_xm11.F | H A D | 13-Oct-2020 | 26.6 KiB | 836 | 658 |
| xc_xmpw91.F | H A D | 13-Oct-2020 | 8.6 KiB | 318 | 193 |
| xc_xmvs15.F | H A D | 13-Oct-2020 | 6.8 KiB | 243 | 140 |
| xc_xn12.F | H A D | 13-Oct-2020 | 8 KiB | 233 | 156 |
| xc_xncap.F | H A D | 13-Oct-2020 | 17.9 KiB | 522 | 335 |
| xc_xpbe96.F | H A D | 13-Oct-2020 | 19.5 KiB | 588 | 363 |
| xc_xpkzb99.F | H A D | 13-Oct-2020 | 11.3 KiB | 402 | 177 |
| xc_xpw6.F | H A D | 13-Oct-2020 | 8.6 KiB | 328 | 201 |
| xc_xpw86.F | H A D | 13-Oct-2020 | 5.9 KiB | 198 | 125 |
| xc_xpw91.F | H A D | 13-Oct-2020 | 3.9 KiB | 150 | 72 |
| xc_xscan.F | H A D | 13-Oct-2020 | 10.4 KiB | 357 | 225 |
| xc_xscanl.F | H A D | 13-Oct-2020 | 8.4 KiB | 310 | 182 |
| xc_xsogga.F | H A D | 13-Oct-2020 | 13.3 KiB | 431 | 324 |
| xc_xtpss03.F | H A D | 13-Oct-2020 | 9.9 KiB | 329 | 203 |
| xc_xvs98.F | H A D | 13-Oct-2020 | 9.6 KiB | 367 | 215 |
| xc_xwpbe.F | H A D | 13-Oct-2020 | 20.3 KiB | 599 | 374 |