Match Hartree energy
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Run foss_mpi_debug_autotools: [foss2023a-mpi] >
Input 01-nio.01-U5-gs.inp
Value | Reference | Precision | Status |
4.643667759000000e+01 | 4.643667351000000e+01 | 9.860000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)