Match Hartree energy
Commits >
Commit 42d5c2c12b8376ac01df1778205b77ce6ca96480 >
Run spack_foss-2022a_cuda_mpi_omp >
Input 23-hybrids.03-Si_pbe0.inp
Value | Reference | Precision | Status |
5.832466300000000e-01 | 5.832466300000000e-01 | 2.920000000000000e-14 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)