Match B3LYP Fock Correlation
Commits >
Commit 42d5c2c12b8376ac01df1778205b77ce6ca96480 >
Run spack_foss-2022a_serial_min >
Input 03-xc.b3lyp_fock.inp
Value | Reference | Precision | Status |
-2.734433000000000e-01 | -2.734403300000000e-01 | 3.280000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Correlation =', 3)