![]() | Name | Last modified | Size | Description |
---|---|---|---|---|
![]() | Parent Directory | - | ||
![]() | GEO_OPT_FAILED | 2018-11-16 06:55 | 149 | |
![]() | basis | 2018-11-15 17:28 | 1.8K | |
![]() | control | 2018-11-16 06:55 | 2.0K | |
![]() | coord | 2018-11-16 06:54 | 5.3K | |
![]() | coord.xyz | 2018-11-15 17:28 | 3.8K | |
![]() | energy | 2018-11-16 06:55 | 31K | |
![]() | geo_00774.bash | 2018-11-15 17:28 | 835 | |
![]() | geo_00774.run | 2018-11-15 17:28 | 436 | |
![]() | gradient | 2018-11-16 06:54 | 5.3M | |
![]() | hessapprox | 2018-11-16 06:54 | 572K | |
![]() | job.last | 2018-11-16 06:55 | 63K | |
![]() | job.start | 2018-11-15 17:30 | 772 | |
![]() | jobex.out | 2018-11-16 06:55 | 11K | |
![]() | mos | 2018-11-16 06:55 | 13M | |
![]() | nextstep | 2018-11-16 06:55 | 5 | |
![]() | not.converged | 2018-11-16 06:54 | 325 | |
![]() | optinfo | 2018-11-16 06:54 | 19K | |
![]() | statistics | 2018-11-16 06:55 | 6.3K | |