Match Partial charge 10
Commits >
Commit a41c007d955b10e3b7368ff6ffc60ddf6399c944 >
Run intel_omp_autotools: [intel2023a-serial] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
4.000000000000000e+00 | 4.000000000000000e+00 | 1.000000000000000e-01 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 11)