Match Hartree energy
Commits >
Commit f72050fe95608e153e1887ef05d1ad42dc082fde >
Run intel_omp_autotools: [intel2022a-serial] >
Input 05-lithium.01-gs.inp
Value | Reference | Precision | Status |
7.485500000000000e-04 | 7.485500000000001e-04 | 3.740000000000000e-16 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)