Match Hartree-Fock Total Energy
Commits >
Commit 70b0ad3565a7ed52254e6fb5a8a40b027abeb4a7 >
Run foss_autotools: [foss2023a-serial] >
Input 01-xc_1d.02-wfs-hf.inp
Value | Reference | Precision | Status |
-5.273627600000000e+00 | -5.273627600000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)