Shared Files
Working directory: |
hp8kfQHWzk / candidates / xtb_vibrational_correction_candidates / NC1(CCCCCl)CCCCC1 / Mo_N |
Info | Select/deselect all files | |||||
1665 Fri May 19 14:33:58 2023 | charges | |||||
0 Fri May 19 14:33:58 2023 | err.out | |||||
1024093 Fri May 19 14:33:58 2023 | g98.out | |||||
26 Fri May 19 14:33:58 2023 | gfn2err.out | |||||
170121 Fri May 19 14:33:58 2023 | gfn2job.out | |||||
1797282 Fri May 19 14:33:58 2023 | hessian | |||||
120 Fri May 19 14:33:58 2023 | job-38278116.er | |||||
143 Fri May 19 14:33:58 2023 | job-38278116.out | |||||
0 Fri May 19 14:33:58 2023 | job.err | |||||
29 Fri May 19 14:33:58 2023 | job.out | |||||
242 Fri May 19 14:33:58 2023 | orca.inp | |||||
134141 Fri May 19 14:33:58 2023 | orca.out | |||||
1055 Fri May 19 14:33:58 2023 | orca.sh | |||||
7609 Fri May 19 14:33:58 2023 | orca.xyz | |||||
3617 Fri May 19 14:33:58 2023 | struct.xyz | |||||
22815 Fri May 19 14:33:58 2023 | vibspectrum | |||||
5916 Fri May 19 14:33:58 2023 | wbo | |||||
585044 Fri May 19 14:33:58 2023 | xtbopt.log | |||||
8732 Fri May 19 14:33:58 2023 | xtbopt.xyz | |||||
9352 Fri May 19 14:33:58 2023 | xtbrestart | |||||
10393 Fri May 19 14:33:58 2023 | xtbtopo.mol |
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