Match Hartree-Fock energy Total
Commits >
Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b >
Run foss-mpi-min: [foss2023a-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)