../
|
data.h
|
40.7 KB
|
907086e
|
17 years
|
FrederikHeber |
-ParallelSimulationData: comments upgraded
-FileData: comments updated …
|
defs.h
|
2.3 KB
|
460e95
|
17 years
|
FrederikHeber |
BOHRRADIUS changed to ANGSTROEMINBOHRRADIUS
|
density.c
|
61.4 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
density.h
|
1.5 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
energy.c
|
34.2 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
energy.h
|
840 bytes
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
errors.c
|
1.6 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
errors.h
|
1001 bytes
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
excor.c
|
41.5 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
excor.h
|
2.9 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
grad.c
|
58.0 KB
|
64fa9e
|
17 years
|
FrederikHeber |
Free(): now takes a debug string to know where free error occured
|
grad.h
|
3.3 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
gramsch.c
|
47.8 KB
|
e00f47
|
17 years
|
FrederikHeber |
GramSchNormalize() added
|
gramsch.h
|
1.7 KB
|
e00f47
|
17 years
|
FrederikHeber |
GramSchNormalize() added
|
helpers.c
|
21.7 KB
|
9275a3
|
17 years
|
FrederikHeber |
Free(): now takes a debug string to know where free error occured …
|
helpers.h
|
2.5 KB
|
9275a3
|
17 years
|
FrederikHeber |
Free(): now takes a debug string to know where free error occured …
|
init.c
|
88.5 KB
|
961b75
|
17 years
|
FrederikHeber |
ParseForParameter() has new parameter repetition, which reads the …
|
init.h
|
2.1 KB
|
961b75
|
17 years
|
FrederikHeber |
ParseForParameter() has new parameter repetition, which reads the …
|
ions.c
|
36.3 KB
|
961b75
|
17 years
|
FrederikHeber |
ParseForParameter() has new parameter repetition, which reads the …
|
ions.h
|
6.6 KB
|
961b75
|
17 years
|
FrederikHeber |
ParseForParameter() has new parameter repetition, which reads the …
|
Makefile.am
|
697 bytes
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
Makefile.in
|
49.6 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
mergesort2.c
|
4.2 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
mergesort2.h
|
918 bytes
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
myfft.c
|
33.5 KB
|
64fa9e
|
17 years
|
FrederikHeber |
Free(): now takes a debug string to know where free error occured
|
myfft.h
|
4.5 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
mymath.c
|
13.9 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
mymath.h
|
4.3 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
opt.c
|
14.4 KB
|
64fa9e
|
17 years
|
FrederikHeber |
Free(): now takes a debug string to know where free error occured
|
opt.h
|
631 bytes
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
output.c
|
83.4 KB
|
961b75
|
17 years
|
FrederikHeber |
ParseForParameter() has new parameter repetition, which reads the …
|
output.h
|
3.9 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
parsetest.c
|
5.4 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
pcp.c
|
43.8 KB
|
64fa9e
|
17 years
|
FrederikHeber |
Free(): now takes a debug string to know where free error occured
|
pcp.h
|
511 bytes
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
pdbformat.c
|
2.7 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
pdbformat.h
|
589 bytes
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
perturbed.c
|
202.8 KB
|
961b75
|
17 years
|
FrederikHeber |
ParseForParameter() has new parameter repetition, which reads the …
|
perturbed.h
|
3.1 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
pseudo.c
|
51.2 KB
|
961b75
|
17 years
|
FrederikHeber |
ParseForParameter() has new parameter repetition, which reads the …
|
pseudo.h
|
4.8 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
riemann.c
|
21.3 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
riemann.h
|
765 bytes
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
run.c
|
80.5 KB
|
27a5bf
|
17 years
|
FrederikHeber |
-StructOpt_...(): Huge changes (from newest svn version) …
|
run.h
|
9.8 KB
|
995ff3
|
17 years
|
FrederikHeber |
declaration of Thermostats() and various variables needed in Run structure
|
test.c
|
13.4 KB
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|
wannier.c
|
70.5 KB
|
961b75
|
17 years
|
FrederikHeber |
ParseForParameter() has new parameter repetition, which reads the …
|
wannier.h
|
541 bytes
|
a0bcf1
|
17 years
|
FrederikHeber |
-initial commit
-Minimum set of files needed from ESPACK SVN …
|