Match Hartree energy
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Run intel_autotools: [intel2023a-serial] >
Input 11-isotopes.01-deuterium.inp
Value | Reference | Precision | Status |
2.955577600000000e-01 | 2.955485500000000e-01 | 3.000000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)