Match Hartree energy
Commits >
Commit 045d20dc05e1b42e239243cb04e8ce4d1aad770d >
Run foss-mpi-full: [foss2023a-mpi] >
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)