Match Hartree energy
Commits >
Commit 9972eae3cc35bad71f44bb929051f5e204f853a2 >
Run cuda-mpi-omp: [foss2022a-cuda-mpi] >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
3.988937003430000e+03 | 3.988936987400000e+03 | 4.670000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)