Match Hartree energy
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Run GCI_foss_min_autotools: [foss2023a-serial] >
Input 12-boron_nitride.01-gs.inp
Value | Reference | Precision | Status |
-5.236158381400001e+02 | -5.236158373600000e+02 | 1.330000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)