Name | Last modified | Size | Description | |
---|---|---|---|---|
Parent Directory | - | |||
Al-vacancy.pwtk | 2024-04-22 09:07 | 2.5K | ||
CO-Rh100-c2x2-2L.xsf | 2021-04-30 20:32 | 361 | ||
CORh.pwtk | 2024-04-22 09:12 | 1.0K | ||
CORh_pwtk42E020Input..> | 2024-11-11 13:53 | 4.4K | ||
Cu.pwtk | 2024-04-22 09:12 | 849 | ||
Cu_pwtk42E020Input20..> | 2024-11-11 13:53 | 4.0K | ||
Fe.pwtk | 2024-07-11 14:43 | 519 | ||
FeO.pwtk | 2024-11-09 23:20 | 1.2K | ||
H2O.pwtk | 2024-04-22 09:12 | 804 | ||
Mn-in-NiO100.pwtk | 2024-04-17 11:20 | 1.3K | ||
N2OPd.pwtk | 2024-10-29 09:03 | 2.7K | ||
N2OPd_pwtk42E020Inpu..> | 2024-11-11 13:53 | 7.8K | ||
NO-Rh100-c2x2-2L.xsf | 2024-04-17 12:23 | 361 | ||
Si.pwtk | 2024-04-22 09:13 | 871 | ||
Si_pwtk42E020Input20..> | 2024-11-11 13:53 | 4.2K | ||
after.pwtk | 2024-07-23 07:40 | 1.3K | ||
after_pwtk42E720Misc..> | 2024-11-11 13:53 | 4.1K | ||
artn.pwtk | 2024-04-23 17:42 | 1.5K | ||
artn_pwtk42E220Plugi..> | 2024-11-11 13:53 | 5.7K | ||
bader-OAl.pwtk | 2024-04-23 17:43 | 889 | ||
bader-OAl_pwtk42E320..> | 2024-11-11 13:53 | 3.2K | ||
bands-Fe.pwtk | 2024-10-23 14:33 | 1.8K | ||
bands-Fe_pwtk42E320W..> | 2024-11-11 13:53 | 7.2K | ||
bands-Si.pwtk | 2024-07-23 09:12 | 2.5K | ||
bands-Si_pwtk42E320W..> | 2024-11-11 13:53 | 8.2K | ||
bands-TiO2.pwtk | 2024-07-23 12:23 | 2.9K | ||
bands-TiO2_pwtk42E32..> | 2024-11-11 13:53 | 11K | ||
bg.pwtk | 2024-07-23 07:33 | 3.7K | ||
bg_pwtk42E520Concurr..> | 2024-11-11 13:53 | 14K | ||
bonding-analysis-COR..> | 2024-07-23 07:40 | 6.2K | ||
bonding-analysis-COR..> | 2024-11-11 13:53 | 18K | ||
calcmol.pwtk | 2024-10-04 15:59 | 1.1K | ||
calcmol_pwtk42E320Wo..> | 2024-11-11 13:53 | 4.3K | ||
clear.pwtk | 2024-10-04 16:00 | 781 | ||
clear_pwtk42E020Inpu..> | 2024-11-11 13:53 | 3.4K | ||
convergence-tests-Cu..> | 2024-04-23 17:41 | 4.9K | ||
convergence-tests-Cu..> | 2024-11-11 13:53 | 15K | ||
data-stack-aux.pwtk | 2024-04-18 12:20 | 1.9K | ||
data-stack.pwtk | 2024-10-04 16:00 | 3.7K | ||
data-stack_pwtk42E12..> | 2024-11-11 13:53 | 12K | ||
difden-OAl.pwtk | 2024-04-23 17:43 | 2.7K | ||
difden-OAl_pwtk42E32..> | 2024-11-11 13:53 | 8.2K | ||
dos-Fe.pwtk | 2024-10-23 14:38 | 575 | ||
dos-Fe_pwtk42E320Wor..> | 2024-11-11 13:53 | 2.8K | ||
environ.pwtk | 2024-04-23 17:42 | 1.2K | ||
environ_pwtk42E220Pl..> | 2024-11-11 13:53 | 4.5K | ||
eos-Si.pwtk | 2024-04-23 17:43 | 642 | ||
eos-Si_pwtk42E320Wor..> | 2024-11-11 13:53 | 2.9K | ||
flo-N2OPd.pwtk | 2024-07-10 10:35 | 1.2K | ||
flo-N2OPd_pwtk42E320..> | 2024-11-11 13:53 | 4.4K | ||
hp-composite.pwtk | 2024-10-04 16:00 | 2.3K | ||
hp-composite_pwtk42E..> | 2024-11-11 13:53 | 8.4K | ||
hp.pwtk | 2024-10-04 16:00 | 3.1K | ||
hp_pwtk42E120Basic20..> | 2024-11-11 13:53 | 9.8K | ||
ildos.xcrysden | 2024-04-05 12:09 | 30K | ||
lobster-CORh.pwtk | 2024-10-23 16:28 | 2.5K | ||
lobster-CORh_pwtk42E..> | 2024-11-11 13:53 | 9.0K | ||
mopdos-CORh.pwtk | 2024-10-23 14:30 | 1.5K | ||
mopdos-CORh_pwtk42E3..> | 2024-11-11 13:53 | 5.9K | ||
neb+artn-N2OPd.pwtk | 2024-10-04 19:53 | 1.2K | ||
neb+artn-N2OPd_pwtk4..> | 2024-11-11 13:53 | 4.2K | ||
neb-N2OPd.pwtk | 2024-10-04 16:00 | 843 | ||
neb-N2OPd_pwtk42E320..> | 2024-11-11 13:53 | 3.3K | ||
neb-refine.pwtk | 2024-10-04 16:00 | 1.1K | ||
neb-refine_pwtk42E32..> | 2024-11-11 13:53 | 4.1K | ||
neb.H2+H.in | 2024-05-09 13:50 | 1.2K | ||
neb_vs_flo_vs_sbco.pwtk | 2024-07-10 10:35 | 1.1K | ||
neb_vs_flo_vs_sbco_p..> | 2024-11-11 13:53 | 5.4K | ||
oscdft.pwtk | 2024-04-23 17:42 | 1.3K | ||
oscdft_pwtk42E220Plu..> | 2024-11-11 13:53 | 4.5K | ||
pdos-CORh.pwtk | 2024-10-23 14:30 | 5.1K | ||
pdos-CORh_pwtk42E320..> | 2024-11-11 13:53 | 16K | ||
pdos-CaF2.pwtk | 2024-11-09 11:56 | 4.1K | ||
pdos-CaF2_pwtk42E320..> | 2024-11-11 13:53 | 12K | ||
pdos-Fe.pwtk | 2024-07-17 15:19 | 1.6K | ||
pdos-FeO.pwtk | 2024-10-23 14:29 | 3.7K | ||
pdos-FeO_pwtk42E320W..> | 2024-11-11 13:53 | 12K | ||
plotting.pwtk | 2024-07-12 18:35 | 1.6K | ||
plotting_pwtk42E720M..> | 2024-11-11 13:53 | 7.8K | ||
propagate.pwtk | 2024-04-20 12:50 | 2.5K | ||
propagate_pwtk42E520..> | 2024-11-11 13:53 | 7.5K | ||
pseudo.pwtk | 2024-07-10 10:34 | 1.3K | ||
pseudo_pwtk42E320Wor..> | 2024-11-11 13:53 | 4.8K | ||
pw.Si.in | 2024-04-22 14:20 | 541 | ||
relax.OAl111-1x1-2L.in | 2024-10-29 08:08 | 769 | ||
remedy.pwtk | 2024-04-23 17:46 | 1.6K | ||
remedy_pwtk42E620Run..> | 2024-11-11 13:53 | 4.8K | ||
remote.pwtk | 2024-07-23 07:32 | 4.8K | ||
remote_pwtk42E520Con..> | 2024-11-11 13:53 | 16K | ||
sbco-N2OPd.pwtk | 2024-07-10 10:35 | 1.5K | ||
sbco-N2OPd_pwtk42E32..> | 2024-11-11 13:53 | 4.4K | ||
scan-Si.pwtk | 2024-04-23 17:41 | 2.7K | ||
scan-Si_pwtk42E120Ba..> | 2024-11-11 13:53 | 7.0K | ||
scanpar-Si.pwtk | 2024-04-23 17:41 | 3.5K | ||
scanpar-Si_pwtk42E12..> | 2024-11-11 13:53 | 10K | ||
scf.Cu.in | 2024-04-22 09:13 | 587 | ||
scf.OAl.in | 2024-04-22 09:13 | 1.4K | ||
scf.Si.in | 2024-04-22 14:20 | 541 | ||
scf.TiO2.in | 2024-07-23 09:09 | 820 | ||
scf.anatase.in | 2024-04-23 11:08 | 1.0K | ||
simple-Si.pwtk | 2024-04-23 17:41 | 1.8K | ||
simple-Si_pwtk42E120..> | 2024-11-11 13:53 | 6.9K | ||
slurm-composite.pwtk | 2024-10-04 16:00 | 4.0K | ||
slurm-composite_pwtk..> | 2024-11-11 13:53 | 13K | ||
slurm-configurable.pwtk | 2024-04-24 10:09 | 3.5K | ||
slurm-configurable_p..> | 2024-11-11 13:53 | 8.9K | ||
slurm-simple.pwtk | 2024-04-22 19:17 | 1.9K | ||
slurm-simple_pwtk42E..> | 2024-11-11 13:53 | 5.9K | ||
stopOnError.pwtk | 2024-04-20 12:43 | 939 | ||
stopOnError_pwtk42E6..> | 2024-11-11 13:53 | 3.4K | ||
tabulate.pwtk | 2024-04-17 15:27 | 1.7K | ||
tabulate_pwtk42E720M..> | 2024-11-11 13:53 | 5.2K | ||
thread.pwtk | 2024-07-23 07:34 | 4.2K | ||
thread_pwtk42E520Con..> | 2024-11-11 13:53 | 15K | ||
topview.xcrysden | 2024-04-17 14:46 | 26K | ||
tpool.pwtk | 2024-07-23 07:34 | 3.9K | ||
tpool_pwtk42E520Conc..> | 2024-11-11 13:53 | 14K | ||
treatrun.pwtk | 2024-04-23 17:46 | 1.7K | ||
treatrun_pwtk42E620R..> | 2024-11-11 13:53 | 5.9K | ||
vib-mol-spectra.pwtk | 2024-04-17 07:30 | 2.5K | ||
vib-mol-spectra_pwtk..> | 2024-11-11 13:53 | 8.2K | ||
xxxrun.pwtk | 2024-04-23 17:46 | 2.5K | ||
xxxrun_pwtk42E620Run..> | 2024-11-11 13:53 | 7.4K | ||