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| Name | Last modified | Size | Description |
|---|---|---|---|---|
| Parent Directory | - | ||
| GEO_OPT_RUNNING | 2017-05-11 14:52 | 1.3K | |
| a2mat.tmp | 2017-05-11 14:52 | 20M | |
| a3mat.tmp | 2017-05-11 14:52 | 4.2M | |
| amat.tmp | 2017-05-11 14:52 | 24M | |
| auxbasis | 2017-05-11 14:52 | 3.6K | |
| auxbgi | 2017-05-11 14:52 | 48 | |
| auxxiv | 2017-05-11 14:52 | 0 | |
| basis | 2017-05-11 14:52 | 3.7K | |
| control | 2017-05-11 14:51 | 3.2K | |
| coord | 2017-05-11 14:51 | 5.5K | |
| cosmo_transfer.tmp | 2017-05-11 14:52 | 281K | |
| ddens | 2017-05-11 14:53 | 4.6M | |
| energy | 2017-05-11 14:52 | 2.4K | |
| forceapprox | 2017-05-11 14:52 | 273K | |
| gradient | 2017-05-11 14:51 | 330K | |
| job.0 | 2017-05-11 14:52 | 69K | |
| job.1 | 2017-05-11 14:52 | 189K | |
| job.2 | 2017-05-11 14:52 | 210K | |
| job.3 | 2017-05-11 14:52 | 502K | |
| job.4 | 2017-05-11 14:52 | 506K | |
| job.5 | 2017-05-11 14:52 | 519K | |
| job.6 | 2017-05-11 14:51 | 523K | |
| job.7 | 2017-05-11 14:52 | 532K | |
| job.8 | 2017-05-11 14:52 | 541K | |
| job.9 | 2017-05-11 14:51 | 538K | |
| job.10 | 2017-05-11 14:52 | 543K | |
| job.11 | 2017-05-11 14:52 | 536K | |
| job.12 | 2017-05-11 14:52 | 534K | |
| job.13 | 2017-05-11 14:52 | 534K | |
| job.14 | 2017-05-11 14:52 | 530K | |
| job.15 | 2017-05-11 14:51 | 532K | |
| job.16 | 2017-05-11 14:52 | 529K | |
| job.17 | 2017-05-11 14:52 | 527K | |
| job.18 | 2017-05-11 14:52 | 527K | |
| job.19 | 2017-05-11 14:52 | 527K | |
| job.20 | 2017-05-11 14:52 | 527K | |
| job.21 | 2017-05-11 14:52 | 525K | |
| job.22 | 2017-05-11 14:52 | 529K | |
| job.23 | 2017-05-11 14:52 | 529K | |
| job.24 | 2017-05-11 14:52 | 528K | |
| job.25 | 2017-05-11 14:51 | 530K | |
| job.26 | 2017-05-11 14:51 | 528K | |
| job.27 | 2017-05-11 14:52 | 529K | |
| job.28 | 2017-05-11 14:52 | 529K | |
| job.29 | 2017-05-11 14:52 | 526K | |
| job.30 | 2017-05-11 14:52 | 529K | |
| job.31 | 2017-05-11 14:52 | 502K | |
| job.last | 2017-05-11 14:52 | 529K | |
| job.start | 2017-05-11 14:52 | 799 | |
| jobex.out | 2017-05-11 14:51 | 673 | |
| mdens | 2017-05-11 14:52 | 4.6M | |
| molden.input | 2017-05-11 13:17 | 161K | |
| mos | 2017-05-11 14:52 | 11M | |
| nextstep | 2017-05-11 14:52 | 6 | |
| not.converged | 2017-05-11 14:52 | 325 | |
| opt_rot.xyz | 2017-05-11 14:52 | 3.2K | |
| out.ccf | 2017-05-11 14:52 | 28K | |
| out_mp2.ccf | 2017-05-11 14:52 | 28K | |
| pij | 2017-05-10 14:46 | 549K | |
| qatocc | 2017-05-11 14:51 | 0 | |
| restart.rimp2 | 2017-05-11 14:52 | 21 | |
| statistics | 2017-05-11 14:52 | 6.3K | |