Match Hartree-Fock eigenvalue up
Commits >
Commit 2ba62b4e5b3c7dac99914e88831daed234f640f9 >
Run foss-2022a_mpi_omp >
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)