Match van der Waals energy
Commits >
Commit c461bdde143a1ab201b7896fffa943f7e4c29d0f >
Run foss-mpi-min: [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)