Match Hartree energy
Commits >
Commit 008ad309696fa333cadd72656d8ad6622d802226 >
Run foss-mpi-debug: [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)