Match Hartree energy
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run foss_mpi_autotools: [foss2022a-mpi] >
Input 08-vdw_ts.01-gs.inp
Value | Reference | Precision | Status |
5.016731445000000e+01 | 5.016731445000000e+01 | 2.510000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)