Match Hartree energy
Commits >
Commit 17b096911440bfe83ad69af07734b73ecc024f80 >
Run spack_foss-2022a_cuda_mpi_omp >
Input 13-primitive.01-diamond.inp
Value | Reference | Precision | Status |
1.000014420000000e+00 | 1.000000000000000e+00 | 5.000000000000000e+00 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)