Match Total energy
Commits >
Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 >
Run spack_foss-2023a_mpi_debug >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
-3.184217039800000e+02 | -3.184216894050000e+02 | 4.780000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)