Match Hartree energy
Commits >
Commit 8ce473bc2e5cdca8ff24e2d00f27e291b995e815 >
Run intel_autotools: [intel2023a-serial] >
Input 18-mgga.06_nccs.inp
Value | Reference | Precision | Status |
3.610155790000000e+00 | 3.610174400000000e+00 | 3.570000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)