Match Hartree energy
Commits >
Commit 15b914f6cf8a906b04634cf1151edac44a3f54fa >
Run cmake_foss_2022a_min_serial >
Input 08-vdw_ts.01-gs.inp
| Value | Reference | Precision | Status |
| 5.016729092000000e+01 | 5.016729092000000e+01 | 2.510000000000000e-10 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)