Match Hartree energy
Commits >
Commit ea6affb390844fd1d159151b43e705a091215c1a >
Run spack_foss-2022a_ppc >
Input 10-vdw_d3_dna.02-gs_d3.inp
Value | Reference | Precision | Status |
3.356150015300000e+02 | 3.356150013750000e+02 | 1.700000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)