Match Hartree-Fock eigenvalue up
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run foss_cmake: [foss2023a-mpi, foss-full-mpi] >
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)