Match Hartree-Fock energy Total
Commits >
Commit 3f3300a09a325083399ad405019c399609c6d1c2 >
Run foss_cmake: [foss2022a-mpi, foss-min-mpi] >
Input 03-xc.01-gs.inp
Value | Reference | Precision | Status |
-7.075616800000000e-01 | -7.075695600000000e-01 | 8.729999999999999e-06 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)