Match Hartree energy
Commits >
Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a >
Run spack_foss-2022a_cuda_mpi_omp >
Input 10-intersite.02-silicon.inp
Value | Reference | Precision | Status |
1.729242888000000e+01 | 1.729242832000000e+01 | 1.900000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)