Match B3LYP OEP Eigenvalue up
Commits >
Commit 34a88ed67d1e43cec43030663c55a516d3c2803d >
Run eb_foss-2022a_mpi >
Input 03-xc.b3lyp_oep.inp
Value | Reference | Precision | Status |
-1.019204000000000e+00 | -1.019171000000000e+00 | 3.630000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 up', 3)