Match Kinetic energy
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run intel-parallel-debug: [intel2023a-mpi] >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
2.253718771300000e+02 | 2.253718767400000e+02 | 9.969999999999999e-06 | PASS |
Command: GREPFIELD(static/info, 'Kinetic =', 3)