Shared Files
Working directory: |
hp8kfQHWzk / candidates / xtb_vibrational_correction_candidates / CC(C)(N)CCC1CCCCC1 / Mo |
Info | Select/deselect all files | |||||
1785 Fri May 19 14:33:43 2023 | charges | |||||
0 Fri May 19 14:33:43 2023 | err.out | |||||
1172189 Fri May 19 14:33:43 2023 | g98.out | |||||
26 Fri May 19 14:33:43 2023 | gfn2err.out | |||||
140655 Fri May 19 14:33:43 2023 | gfn2job.out | |||||
2066040 Fri May 19 14:33:43 2023 | hessian | |||||
0 Fri May 19 14:33:43 2023 | job.err | |||||
28 Fri May 19 14:33:43 2023 | job.out | |||||
324 Fri May 19 14:33:43 2023 | orca.inp | |||||
220591 Fri May 19 14:33:43 2023 | orca.out | |||||
1520 Fri May 19 14:33:43 2023 | orca.sh | |||||
8133 Fri May 19 14:33:43 2023 | orca.xyz | |||||
545 Fri May 19 14:33:43 2023 | slurm-6007019.out | |||||
4765 Fri May 19 14:33:43 2023 | struct.xyz | |||||
24447 Fri May 19 14:33:43 2023 | vibspectrum | |||||
6426 Fri May 19 14:33:43 2023 | wbo | |||||
290036 Fri May 19 14:33:43 2023 | xtbopt.log | |||||
9356 Fri May 19 14:33:43 2023 | xtbopt.xyz | |||||
9960 Fri May 19 14:33:43 2023 | xtbrestart | |||||
11151 Fri May 19 14:33:43 2023 | xtbtopo.mol |
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