Match Hartree energy
Commits >
Commit 49118372ba86b967cc9f5fccbbf24835f53b10d7 >
Run spack_foss-2023a_mpi_opt >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
3.954895210580000e+03 | 3.954895210660000e+03 | 4.180000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)