Match Kinetic energy
Commits >
Commit 155f01ef7d18124a1050c3611747e8f8b44bbe31 >
Run foss-mpi-debug: [foss2023a-mpi] >
Input 08-vdw_ts.01-gs.inp
Value | Reference | Precision | Status |
1.835121371000000e+01 | 1.835121371000000e+01 | 9.180000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Kinetic =', 3)