Match Hartree energy
Commits >
Commit 224605379ecf56495eac19edf712806ff1f57d89 >
Run foss_cuda_autotools: [foss2022a-cuda-mpi] >
Input 13-primitive.01-diamond.inp
Value | Reference | Precision | Status |
1.000006560000000e+00 | 1.000000000000000e+00 | 5.000000000000000e+00 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)