Match Hartree energy
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
Run intel_omp_autotools: [intel2022a-serial] >
Input 03-sodium_chain.01-ground_state.inp
Value | Reference | Precision | Status |
-4.551474880000000e+00 | -4.551474860000000e+00 | 2.280000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)