Restore consistent compressed Deep Potential tabulation
Restore consistent compressed Deep Potential tabulation: a task in SWE-bench-Science (Harbor dataset). A molecular-simulation group is evaluating a compressed Deep Potential workflow using the supplied C++ source snapshot. The calculation completes and returns finite descriptor contributions and…
The task
A molecular-simulation group is evaluating a compressed Deep Potential workflow using the supplied C++ source snapshot. The calculation completes and returns finite descriptor contributions and finite sensitivity values, but a small sweep of compressed-table observations is not consistent with the energy-force…
Part of OpenMOSS-Team/SWE-bench-Science.