Match van der Waals energy
Commits >
Commit ff858744384f796bd1ad65ff45f26dd2d219c42c >
Run intel_omp_autotools: [intel2023a-serial] >
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)