Match Hartree energy
Commits >
Commit 2cbd57b62c972cb2ebea8f328fb20b62d521e0ac >
Run spack_foss-2023a_serial_omp >
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)