Match B3LYP Fock Total
Commits >
Commit e0b7240ece6c1278a2610f2d337090ca4d2c526d >
Run spack_foss-2023b_serial >
Input 03-xc.b3lyp_fock.inp
| Value | Reference | Precision | Status |
| -5.764171800000000e-01 | -5.764007400000000e-01 | 1.810000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)