Match Hartree energy
Commits >
Commit 6e9e1a4536d8fe2a292bd24d601ed608cb4be1e6 >
Run foss-mpi-min: [foss2023a-mpi] >
Input 14-carbon_dojo_psp8.01-gs.inp
Value | Reference | Precision | Status |
1.205215187200000e+02 | 1.205215187200000e+02 | 1.210000000000000e-12 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)