Match Initial energy
Commits >
Commit b2c9b4a951ad3e3faeb99c2d543d652f634c0371 >
Run intel-2022b >
Input 21-scissor.01-gs.inp
Value | Reference | Precision | Status |
-4.174917300000000e-01 | -4.174745000000000e-01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)