scf_dft - OpenGrok cross reference for /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwdft/scf

Name		Date	Size	#Lines	LOC
..		13-Oct-2020	-
GNUmakefile	H A D	13-Oct-2020	1.7 KiB	73	52
cdft_util.F	H A D	13-Oct-2020	34 KiB	1,050	819
dft_canorg.F	H A D	13-Oct-2020	14.6 KiB	487	381
dft_conv.fh	H A D	13-Oct-2020	1.1 KiB	35	31
dft_dencvg.F	H A D	13-Oct-2020	2.3 KiB	74	53
dft_densm.F	H A D	13-Oct-2020	19.2 KiB	632	489
dft_diagn.F	H A D	13-Oct-2020	13 KiB	446	304
dft_dump_info.F	H A D	13-Oct-2020	3.7 KiB	116	96
dft_fant.F	H A D	13-Oct-2020	1.6 KiB	54	27
dft_fdist.fh	H A D	13-Oct-2020	1.2 KiB	38	36
dft_fdist_init.F	H A D	13-Oct-2020	1.4 KiB	34	26
dft_fock_efield.F	H A D	13-Oct-2020	7.2 KiB	227	111
dft_fockbld.F	H A D	13-Oct-2020	21.6 KiB	655	366
dft_frac_mo.F	H A D	13-Oct-2020	3.3 KiB	116	74
dft_invdiag.F	H A D	13-Oct-2020	2.2 KiB	84	50
dft_main0d.F	H A D	13-Oct-2020	25.3 KiB	737	524
dft_mxovl.F	H A D	13-Oct-2020	3.5 KiB	124	82
dft_mxspin_ovlp.F	H A D	13-Oct-2020	12.1 KiB	409	256
dft_nwmolden.F	H A D	13-Oct-2020	8.1 KiB	258	180
dft_printinfo.F	H A D	13-Oct-2020	2 KiB	67	50
dft_pstat.F	H A D	13-Oct-2020	6.1 KiB	121	102
dft_s2_value.F	H A D	13-Oct-2020	2 KiB	66	39
dft_scf.F	H A D	13-Oct-2020	84.4 KiB	2,544	1,822
dft_scfcvg.F	H A D	13-Oct-2020	3 KiB	110	74
dft_scfutil.F	H A D	13-Oct-2020	6.3 KiB	222	158
dft_spinflip.F	H A D	13-Oct-2020	2.5 KiB	76	50
dft_swapab.F	H A D	13-Oct-2020	1.2 KiB	48	29
dft_symbr.F	H A D	13-Oct-2020	1.6 KiB	49	32
dftps.fh	H A D	13-Oct-2020	756	22	19
diis_bld12.F	H A D	13-Oct-2020	2.6 KiB	85	54
diis_bsolve.F	H A D	13-Oct-2020	3.8 KiB	127	58
diis_core.F	H A D	13-Oct-2020	3.5 KiB	130	55
diis_driver.F	H A D	13-Oct-2020	7.2 KiB	235	146
diis_hamwgt.F	H A D	13-Oct-2020	2 KiB	77	47
fukui.F	H A D	13-Oct-2020	34 KiB	933	715
print_irrep_occp.F	H A D	13-Oct-2020	2.1 KiB	76	54