Match Hartree-Fock eigenvalue 1 up
Commits >
Commit fb3b67f6830f0e047754886f078a46875acffbf8 >
Run valgrind: [foss2023a-serial] >
Input 02-xc_2d.02-hf.inp
Value | Reference | Precision | Status |
5.375140000000000e-01 | 5.375150000000000e-01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, ' 1 up', 3)