Match Total energy
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run intel-min-parallel: [intel2022a-mpi] >
Input 13-primitive.03-bcc_iron.inp
Value | Reference | Precision | Status |
-1.258758971700000e+02 | -1.258758971700000e+02 | 6.290000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)