src - OpenGrok cross reference for /dports/science/erkale-pseudopotentials/erkale-870e772f09631b3dbdd99a18e4f3d4786d684a01/src/

Name		Date	Size	#Lines	LOC
..		03-May-2022	-
atom/	H	03-May-2022	-	1,469	907
basistool/	H	03-May-2022	-	884	559
casida/	H	03-May-2022	-	1,826	1,092
completeness/	H	03-May-2022	-	1,330	720
contrib/	H	03-May-2022	-	9,440	6,124
emd/	H	03-May-2022	-	4,188	2,328
external/	H	03-May-2022	-	3,599	2,342
slaterfit/	H	03-May-2022	-	774	412
test/	H	03-May-2022	-	734	501
xrs/	H	03-May-2022	-	3,280	1,878
bader.cpp	H A D	27-Apr-2020	37.6 KiB	1,439	944
bader.h	H A D	27-Apr-2020	4.2 KiB	148	53
badergrid.cpp	H A D	27-Apr-2020	15.6 KiB	593	396
badergrid.h	H A D	27-Apr-2020	2.3 KiB	87	27
basis.cpp	H A D	27-Apr-2020	103.7 KiB	4,086	2,576
basis.h	H A D	27-Apr-2020	23.6 KiB	728	268
basislibrary.cpp	H A D	27-Apr-2020	57.9 KiB	2,317	1,569
basislibrary.h	H A D	27-Apr-2020	9.7 KiB	327	105
boys.cpp	H A D	27-Apr-2020	3.3 KiB	162	97
boys.h	H A D	27-Apr-2020	1.3 KiB	52	18
broyden.cpp	H A D	27-Apr-2020	2.6 KiB	115	66
broyden.h	H A D	27-Apr-2020	2.2 KiB	87	23
chebyshev.cpp	H A D	27-Apr-2020	2.3 KiB	100	49
chebyshev.h	H A D	27-Apr-2020	1.3 KiB	35	8
checkpoint.cpp	H A D	27-Apr-2020	31.2 KiB	1,233	751
checkpoint.h	H A D	27-Apr-2020	4.4 KiB	188	71
cube.cpp	H A D	27-Apr-2020	29.9 KiB	1,142	762
density_fitting.cpp	H A D	27-Apr-2020	28.7 KiB	1,173	838
density_fitting.h	H A D	27-Apr-2020	5.2 KiB	174	55
dftfuncs.cpp	H A D	27-Apr-2020	16.2 KiB	714	524
dftfuncs.h	H A D	27-Apr-2020	2.3 KiB	79	27
dftgrid.cpp	H A D	27-Apr-2020	128.9 KiB	5,278	3,504
dftgrid.h	H A D	27-Apr-2020	27.1 KiB	800	346
diis.cpp	H A D	27-Apr-2020	15.5 KiB	652	421
diis.h	H A D	27-Apr-2020	6.1 KiB	236	79
elements.cpp	H A D	27-Apr-2020	1.8 KiB	84	48
elements.h	H A D	27-Apr-2020	5.8 KiB	101	58
eri_digest.cpp	H A D	27-Apr-2020	14.3 KiB	566	322
eri_digest.h	H A D	27-Apr-2020	3.3 KiB	133	60
erichol.cpp	H A D	27-Apr-2020	21.9 KiB	862	615
erichol.h	H A D	27-Apr-2020	2.8 KiB	102	38
erifit.cpp	H A D	27-Apr-2020	17.7 KiB	662	404
erifit.h	H A D	27-Apr-2020	2.5 KiB	69	25
eriscreen.cpp	H A D	27-Apr-2020	22 KiB	900	645
eriscreen.h	H A D	27-Apr-2020	5 KiB	124	43
eritable.cpp	H A D	27-Apr-2020	6.6 KiB	300	197
eritable.h	H A D	27-Apr-2020	2.4 KiB	100	33
eriworker.cpp	H A D	27-Apr-2020	38.1 KiB	1,488	987
eriworker.h	H A D	27-Apr-2020	6.2 KiB	204	87
eriworker_gentransform.cpp	H A D	27-Apr-2020	4.4 KiB	151	109
find_molecules.cpp	H A D	27-Apr-2020	7.7 KiB	270	124
find_molecules.h	H A D	27-Apr-2020	1.1 KiB	33	8
gaunt.cpp	H A D	27-Apr-2020	1.6 KiB	66	31
gaunt.h	H A D	27-Apr-2020	1.1 KiB	48	14
gdm.cpp	H A D	27-Apr-2020	1.2 KiB	55	25
gdm.h	H A D	27-Apr-2020	1.1 KiB	49	16
genlinconf.cpp	H A D	27-Apr-2020	20.4 KiB	692	497
geometry.cpp	H A D	27-Apr-2020	30.6 KiB	1,203	820
global.h	H A D	27-Apr-2020	5.1 KiB	146	50
guess.cpp	H A D	27-Apr-2020	15.6 KiB	594	383
guess.h	H A D	27-Apr-2020	3.1 KiB	107	25
hirshfeld.cpp	H A D	27-Apr-2020	7 KiB	292	183
hirshfeld.h	H A D	27-Apr-2020	2.4 KiB	96	38
hirshfeldi.cpp	H A D	27-Apr-2020	8.1 KiB	324	199
hirshfeldi.h	H A D	27-Apr-2020	2.1 KiB	65	20
integrals.cpp	H A D	27-Apr-2020	12.6 KiB	441	209
integrals.h	H A D	27-Apr-2020	2.1 KiB	50	13
lbfgs.cpp	H A D	27-Apr-2020	1.9 KiB	92	46
lbfgs.h	H A D	27-Apr-2020	1.2 KiB	53	18
lebedev.cpp	H A D	27-Apr-2020	180.1 KiB	5,438	5,138
lebedev.h	H A D	27-Apr-2020	1.9 KiB	54	17
linalg.cpp	H A D	27-Apr-2020	18.2 KiB	734	451
linalg.h	H A D	27-Apr-2020	5.8 KiB	182	69
lmgrid.cpp	H A D	27-Apr-2020	11.9 KiB	465	275
lmgrid.h	H A D	27-Apr-2020	2.8 KiB	83	31
lobatto.cpp	H A D	27-Apr-2020	26.9 KiB	758	560
lobatto.h	H A D	27-Apr-2020	819	28	5
localization.cpp	H A D	27-Apr-2020	31 KiB	1,334	942
localization.h	H A D	27-Apr-2020	7.6 KiB	285	123
localize.cpp	H A D	27-Apr-2020	18.3 KiB	614	383
main.cpp	H A D	27-Apr-2020	3.9 KiB	163	111
mathf.cpp	H A D	27-Apr-2020	10.9 KiB	460	282
mathf.h	H A D	27-Apr-2020	5 KiB	182	84
obara-saika.cpp	H A D	27-Apr-2020	56.9 KiB	2,066	1,319
obara-saika.h	H A D	27-Apr-2020	5.1 KiB	79	25
population.cpp	H A D	27-Apr-2020	9.8 KiB	379	258
properties.cpp	H A D	27-Apr-2020	23.3 KiB	865	495
properties.h	H A D	27-Apr-2020	7.4 KiB	176	56
pzstability.cpp	H A D	27-Apr-2020	80.8 KiB	3,186	2,322
pzstability.h	H A D	27-Apr-2020	8.1 KiB	260	110
sap.cpp	H A D	27-Apr-2020	1.9 KiB	76	39
sap.h	H A D	27-Apr-2020	787	39	13
scf-base.cpp	H A D	27-Apr-2020	91.8 KiB	3,361	2,378
scf-fock.cpp.in	H A D	27-Apr-2020	24.2 KiB	941	815
scf-force.cpp.in	H A D	27-Apr-2020	4.2 KiB	157	126
scf-includes.cpp.in	H A D	27-Apr-2020	930	42	37
scf-solvers.cpp.in	H A D	27-Apr-2020	22.2 KiB	849	722
scf.h	H A D	27-Apr-2020	16.6 KiB	557	226
settings.cpp	H A D	27-Apr-2020	18.7 KiB	588	393
settings.h	H A D	27-Apr-2020	4.6 KiB	153	64
solidharmonics.cpp	H A D	27-Apr-2020	4.1 KiB	206	122
solidharmonics.h	H A D	27-Apr-2020	898	39	8
spherical_harmonics.cpp	H A D	27-Apr-2020	2.5 KiB	90	44
spherical_harmonics.h	H A D	27-Apr-2020	1.1 KiB	35	8
stockholder.cpp	H A D	27-Apr-2020	11.4 KiB	457	246
stockholder.h	H A D	27-Apr-2020	2.4 KiB	82	28
stringutil.cpp	H A D	27-Apr-2020	13.6 KiB	612	405
stringutil.h	H A D	27-Apr-2020	2.9 KiB	95	31
tempered.cpp	H A D	27-Apr-2020	2.2 KiB	99	48
tempered.h	H A D	27-Apr-2020	1.9 KiB	64	12
timer.cpp	H A D	27-Apr-2020	3.3 KiB	161	98
timer.h	H A D	27-Apr-2020	1.5 KiB	84	26
trrh.cpp	H A D	27-Apr-2020	8.3 KiB	314	195
trrh.h	H A D	27-Apr-2020	1.3 KiB	38	7
unitary.cpp	H A D	27-Apr-2020	27.7 KiB	1,176	735
unitary.h	H A D	27-Apr-2020	7.3 KiB	263	106
xyzutils.cpp	H A D	27-Apr-2020	4.5 KiB	167	104
xyzutils.h	H A D	27-Apr-2020	1.4 KiB	56	18
zmatrix.cpp	H A D	27-Apr-2020	8.2 KiB	317	210
zmatrix.h	H A D	27-Apr-2020	741	29	7