Match Hartree energy
Commits >
Commit c461bdde143a1ab201b7896fffa943f7e4c29d0f >
Run intel_omp_autotools: [intel2023a-serial] >
Input 15-calcium_psp8_sic.01-gs.inp
Value | Reference | Precision | Status |
1.547828800000000e-01 | 1.547828500000000e-01 | 3.000000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)