Match van der Waals energy
Commits >
Commit e5fcdd4b6e483a88fb99eafb58d1df80750fbe8c >
Run intel-2022a >
Input 10-vdw_d3_dna.02-gs_d3.inp
Value | Reference | Precision | Status |
-1.168774800000000e-01 | -1.168774800000000e-01 | 5.840000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'vanderWaals =', 3)