Match Hartree energy
Commits >
Commit 4b6d45842a438d46c51308ffa6e74b875e60d9e9 >
Run foss_mpi_omp_autotools: [foss2023a-mpi] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
3.954895867560000e+03 | 3.954895868660000e+03 | 4.100000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)