Match Kinetic energy
Commits >
Commit f72050fe95608e153e1887ef05d1ad42dc082fde >
Run foss-mpi-opt-full: [foss2023a-mpi] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
2.086213812500000e+02 | 2.086213890000000e+02 | 1.040000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Kinetic =', 3)