Match van der Waals energy
Commits >
Commit 68887e7ef149674fa38f143e8d88a44249e6d867 >
Run foss-mpi-full: [foss2023a-mpi] >
Input 08-vdw_ts.01-gs.inp
Value | Reference | Precision | Status |
-6.806400000000000e-04 | -6.806400000000000e-04 | 3.400000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'vanderWaals =', 3)