Match Hartree-Fock eigenvalue up
Commits >
Commit 4104ea28a473696fae3c7fad4406bf86d5f6976c >
Run intel_autotools: [intel2023a-serial] >
Input 03-xc.01-gs.inp
Value | Reference | Precision | Status |
-1.128668000000000e+00 | -1.128664000000000e+00 | 4.400000000000000e-06 | PASS |
Command: GREPFIELD(static/info, ' 1 up', 3)