Match Kinetic energy
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Run GCI_foss_mpi_min_autotools: [foss2022a-mpi] >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
2.253718676800000e+02 | 2.253718767400000e+02 | 3.830000000000000e-06 | FAIL |
Command: GREPFIELD(static/info, 'Kinetic =', 3)