Match Hartree energy
Commits >
Commit babc485c55a2119a415aa56305cb49f398154cb7 >
Run spack_foss-2022a_mpi_opt >
Input 07-sic.02-scdm.inp
Value | Reference | Precision | Status |
1.818234495000000e+01 | 1.818233363000000e+01 | 1.250000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)