Match Hartree energy
Commits >
Commit 61d12a07bb2f18211cbe349e5d87c7e10e0bf297 >
Run foss-mpi-omp-full: [foss2023a-mpi] >
Input 08-vdw_ts.01-gs.inp
Value | Reference | Precision | Status |
4.896672443000000e+01 | 4.896672443000000e+01 | 2.450000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)