SLICES: An Invertible, Invariant, and String-based Crystal Representation [2023, Nature Communications] MatterGPT - agave-li/slices.github.io ...

We attempted to run the source code without relying on Docker, but the generated “mp20_eform_bandgap_nonmetal.csv” was empty. We traced back to the file "0_run.py" and found that the exception capture ...