Match B3LYP Fock Total
Commits >
Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a >
Run spack_foss-2022a_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)