Match Hartree-Fock Eigenvalue 1 up
Commits >
Commit bae4500c7a0d1ba65b012093daf21b2d064fac81 >
Run spack_foss-2022a_cuda_serial >
Input 01-xc_1d.02-wfs-hf.inp
Value | Reference | Precision | Status |
-1.126189000000000e+00 | -1.126189000000000e+00 | 5.630000000000000e-06 | PASS |
Command: GREPFIELD(static/info, ' 1 up', 3)