Match Hartree energy
Commits >
Commit 045d20dc05e1b42e239243cb04e8ce4d1aad770d >
Run foss-serial-min: [foss2022a-serial] >
Input 24-hartree_fock_1D.02-noACE.inp
Value | Reference | Precision | Status |
4.329632200000000e-01 | 2.031368000000000e-01 | 1.020000000000000e-06 | FAIL |
Command: GREPFIELD(static/info, 'Hartree =', 3)