Match step 11 geometry files
Commits >
Commit 9c86d3f9e0672ab6f34186f0e6ca5b729d8f047e >
Run intel-2022b >
Input 05-output.01-gs-set1.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: SHELL(ls -A output_iter/scf.0011/ | wc -l)