Name | Last modified | Size | Description | |
---|---|---|---|---|
Parent Directory | - | |||
slurm-179875.out | 2023-05-18 16:07 | 0 | ||
sbatch_GMIN_mpi_nest | 2023-05-18 16:07 | 559 | ||
perm.allow | 2023-05-18 16:07 | 216 | ||
output.16 | 2023-05-18 16:07 | 33K | ||
output.15 | 2023-05-18 16:07 | 34K | ||
output.14 | 2023-05-18 16:07 | 35K | ||
output.13 | 2023-05-18 16:07 | 36K | ||
output.12 | 2023-05-18 16:07 | 34K | ||
output.11 | 2023-05-18 16:07 | 34K | ||
output.10 | 2023-05-18 16:07 | 33K | ||
output.9 | 2023-05-18 16:07 | 36K | ||
output.8 | 2023-05-18 16:07 | 35K | ||
output.7 | 2023-05-18 16:07 | 33K | ||
output.6 | 2023-05-18 16:07 | 33K | ||
output.5 | 2023-05-18 16:07 | 36K | ||
output.4 | 2023-05-18 16:07 | 35K | ||
output.3 | 2023-05-18 16:07 | 32K | ||
output.2 | 2023-05-18 16:07 | 33K | ||
output.1 | 2023-05-18 16:07 | 38K | ||
output | 2023-05-18 16:07 | 186K | ||
nodes.info | 2023-05-18 16:07 | 213 | ||
min.rst | 2023-05-18 16:07 | 0 | ||
min.out | 2023-05-18 16:07 | 5.5K | ||
min.in | 2023-05-18 16:07 | 731 | ||
markov.16 | 2023-05-18 16:07 | 3.0K | ||
markov.15 | 2023-05-18 16:07 | 3.0K | ||
markov.14 | 2023-05-18 16:07 | 3.0K | ||
markov.13 | 2023-05-18 16:07 | 3.0K | ||
markov.12 | 2023-05-18 16:07 | 3.0K | ||
markov.11 | 2023-05-18 16:07 | 3.0K | ||
markov.10 | 2023-05-18 16:07 | 3.0K | ||
markov.9 | 2023-05-18 16:07 | 3.0K | ||
markov.8 | 2023-05-18 16:07 | 3.0K | ||
markov.7 | 2023-05-18 16:07 | 3.0K | ||
markov.6 | 2023-05-18 16:07 | 3.0K | ||
markov.5 | 2023-05-18 16:07 | 3.0K | ||
markov.4 | 2023-05-18 16:07 | 3.0K | ||
markov.3 | 2023-05-18 16:07 | 3.0K | ||
markov.2 | 2023-05-18 16:07 | 3.0K | ||
markov.1 | 2023-05-18 16:07 | 3.0K | ||
lowest.16 | 2023-05-18 16:07 | 85K | ||
lowest.15 | 2023-05-18 16:07 | 135K | ||
lowest.14 | 2023-05-18 16:07 | 128K | ||
lowest.13 | 2023-05-18 16:07 | 149K | ||
lowest.12 | 2023-05-18 16:07 | 128K | ||
lowest.11 | 2023-05-18 16:07 | 135K | ||
lowest.10 | 2023-05-18 16:07 | 121K | ||
lowest.9 | 2023-05-18 16:07 | 185K | ||
lowest.8 | 2023-05-18 16:07 | 178K | ||
lowest.7 | 2023-05-18 16:07 | 121K | ||
lowest.6 | 2023-05-18 16:07 | 100K | ||
lowest.5 | 2023-05-18 16:07 | 185K | ||
lowest.4 | 2023-05-18 16:07 | 128K | ||
lowest.3 | 2023-05-18 16:07 | 78K | ||
lowest.2 | 2023-05-18 16:07 | 100K | ||
lowest.1 | 2023-05-18 16:07 | 185K | ||
jobnumber | 2023-05-18 16:07 | 76 | ||
initial_cis_trans_states | 2023-05-18 16:07 | 308 | ||
initial_chiral_states | 2023-05-18 16:07 | 216 | ||
energy.16 | 2023-05-18 16:07 | 3.0K | ||
energy.15 | 2023-05-18 16:07 | 3.0K | ||
energy.14 | 2023-05-18 16:07 | 3.0K | ||
energy.13 | 2023-05-18 16:07 | 3.0K | ||
energy.12 | 2023-05-18 16:07 | 3.0K | ||
energy.11 | 2023-05-18 16:07 | 3.0K | ||
energy.10 | 2023-05-18 16:07 | 3.0K | ||
energy.9 | 2023-05-18 16:07 | 3.0K | ||
energy.8 | 2023-05-18 16:07 | 3.0K | ||
energy.7 | 2023-05-18 16:07 | 3.0K | ||
energy.6 | 2023-05-18 16:07 | 3.0K | ||
energy.5 | 2023-05-18 16:07 | 3.0K | ||
energy.4 | 2023-05-18 16:07 | 3.0K | ||
energy.3 | 2023-05-18 16:07 | 3.0K | ||
energy.2 | 2023-05-18 16:07 | 3.0K | ||
energy.1 | 2023-05-18 16:07 | 3.0K | ||
data | 2023-05-18 16:07 | 1.9K | ||
coords.prmtop | 2023-05-18 16:07 | 54K | ||
coords.inpcrd | 2023-05-18 16:07 | 3.9K | ||
best.16 | 2023-05-18 16:07 | 3.0K | ||
best.15 | 2023-05-18 16:07 | 3.0K | ||
best.14 | 2023-05-18 16:07 | 3.0K | ||
best.13 | 2023-05-18 16:07 | 3.0K | ||
best.12 | 2023-05-18 16:07 | 3.0K | ||
best.11 | 2023-05-18 16:07 | 3.0K | ||
best.10 | 2023-05-18 16:07 | 3.0K | ||
best.9 | 2023-05-18 16:07 | 3.0K | ||
best.8 | 2023-05-18 16:07 | 3.0K | ||
best.7 | 2023-05-18 16:07 | 3.0K | ||
best.6 | 2023-05-18 16:07 | 3.0K | ||
best.5 | 2023-05-18 16:07 | 3.0K | ||
best.4 | 2023-05-18 16:07 | 3.0K | ||
best.3 | 2023-05-18 16:07 | 3.0K | ||
best.2 | 2023-05-18 16:07 | 3.0K | ||
best.1 | 2023-05-18 16:07 | 3.0K | ||
atomgroups | 2023-05-18 16:07 | 561 | ||
GMIN.dump.16 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.15 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.14 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.13 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.12 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.11 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.10 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.9 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.8 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.7 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.6 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.5 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.4 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.3 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.2 | 2023-05-18 16:07 | 231K | ||
GMIN.dump.1 | 2023-05-18 16:07 | 231K | ||