Match Total energy
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run intel-parallel-debug: [intel2023a-mpi] >
Input 24-o2-spin.01-gs.inp
Value | Reference | Precision | Status |
-3.141062482000000e+01 | -3.141062482000000e+01 | 1.570000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)