Match Hartree energy
Commits >
Commit 85779d3dd9ec6e18544835020e079bae8c405b87 >
Run spack_foss-2022a_mpi >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
3.988936437780000e+03 | 3.988936413230000e+03 | 2.750000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)