Match Hartree energy
Commits >
Commit d89ed1adec8f63937926022ba961c15ddb98b66b >
Run foss-serial-min: [foss2023b-serial] >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
3.988936999680000e+03 | 3.988936987400000e+03 | 4.670000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)