Shared Files
| Working directory: |
| hp8kfQHWzk / candidates / xtb_vibrational_correction_candidates / CC(N)Cc1ccc(CCl)cc1 / Mo_NNH3+ |
| Info | Select/deselect all files | |||||
| 1455 Fri May 19 14:34:08 2023 | charges | |||||
| 0 Fri May 19 14:34:08 2023 | err.out | |||||
| 788949 Fri May 19 14:34:08 2023 | g98.out | |||||
| 26 Fri May 19 14:34:08 2023 | gfn2err.out | |||||
| 165902 Fri May 19 14:34:08 2023 | gfn2job.out | |||||
| 1373310 Fri May 19 14:34:08 2023 | hessian | |||||
| 0 Fri May 19 14:34:08 2023 | job.err | |||||
| 28 Fri May 19 14:34:08 2023 | job.out | |||||
| 324 Fri May 19 14:34:08 2023 | orca.inp | |||||
| 214281 Fri May 19 14:34:08 2023 | orca.out | |||||
| 1520 Fri May 19 14:34:08 2023 | orca.sh | |||||
| 6668 Fri May 19 14:34:08 2023 | orca.xyz | |||||
| 5361 Fri May 19 14:34:08 2023 | orca_restart.xyz | |||||
| 562 Fri May 19 14:34:08 2023 | slurm-6001646.out | |||||
| 3186 Fri May 19 14:34:08 2023 | struct.xyz | |||||
| 19959 Fri May 19 14:34:08 2023 | vibspectrum | |||||
| 5661 Fri May 19 14:34:08 2023 | wbo | |||||
| 7591 Fri May 19 14:34:08 2023 | xtbhess.xyz | |||||
| 519452 Fri May 19 14:34:08 2023 | xtbopt.log | |||||
| 7639 Fri May 19 14:34:08 2023 | xtbopt.xyz | |||||
| 8240 Fri May 19 14:34:08 2023 | xtbrestart | |||||
| 9145 Fri May 19 14:34:08 2023 | xtbtopo.mol | |||||
| File view options | |||
| Parameter | Setting | Enable | Disable |
| Long format | False | ||
| Recursion | False | ||
| Show hidden files | False | ||
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