Match Hartree energy
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Run foss_mpi_autotools: [foss2023a-mpi] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
3.954895867550000e+03 | 3.954895868660000e+03 | 1.440000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)