Match Hartree energy
Commits >
Commit c461bdde143a1ab201b7896fffa943f7e4c29d0f >
Run foss-ppc: [foss2022a-serial] >
Input 22-vdw_d3_stress.01-Be_hpc.inp
Value | Reference | Precision | Status |
2.826116990000000e+00 | 2.826117060000000e+00 | 1.410000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)