Match Hartree energy
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run foss_autotools: [foss2022a-serial] >
Input 05-lithium.01-gs.inp
Value | Reference | Precision | Status |
7.485500000000000e-04 | 7.485500000000001e-04 | 3.740000000000000e-16 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)