Match Kinetic energy
Commits >
Commit 584f61e8603689505e758f366f49c21c2e481def >
Run foss-mpi-min: [foss2023a-mpi] >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
2.253718676800000e+02 | 2.253718767400000e+02 | 2.030000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Kinetic =', 3)