Match Hartree energy
Commits >
Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a >
Run GCI_foss_mpi_min_autotools: [foss2023a-mpi] >
Input 11-vdw_d3.01-gs.inp
Value | Reference | Precision | Status |
5.035655250000000e+01 | 5.035655249999999e+01 | 5.040000000000000e-13 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)