Match Hartree energy
Commits >
Commit 42d5c2c12b8376ac01df1778205b77ce6ca96480 >
Run spack_foss-2023a_mpi_opt >
Input 10-intersite.02-silicon.inp
Value | Reference | Precision | Status |
1.729242799000000e+01 | 1.729242832000000e+01 | 1.900000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)