Match Kinetic energy
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Run intel_autotools: [intel2023a-serial] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
2.086213889900000e+02 | 2.086213886100000e+02 | 2.600000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Kinetic =', 3)