Match B3LYP Fock Eigenvalue up
Commits >
Commit e5fcdd4b6e483a88fb99eafb58d1df80750fbe8c >
Run cmake_foss_2022a_full_mpi >
Input 03-xc.b3lyp_fock.inp
Value | Reference | Precision | Status |
-1.019204000000000e+00 | -1.019171000000000e+00 | 3.630000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 up', 3)