Published July 12, 2024 | Version v1
Dataset Open

Dismai-Bench Datasets and Interatomic Potentials

Authors/Creators

  • 1. ROR icon University of Illinois Urbana-Champaign

Description

Datasets and interatomic potentials for Dismai-Bench, a generative model benchmark for inorganic materials. Dismai-Bench evaluates models on large disordered materials and interfaces, through direct comparisons between training structures and generated structures.

Files

dismai_bench_train_ref_data.zip

Files (794.0 MB)

Name Size
md5:b79d7fd111a1144d9f35ada8c6618334
60.7 MB Preview Download
md5:08f64f43187de2dd110cb8b8cc47c08d
207.2 MB Preview Download
md5:be806392d79812417b72eb5fea1ecded
86.2 MB Preview Download
md5:adf2ffcdb6ae964f525c072e82663c44
440.0 MB Preview Download

Additional details

Related works

Is published in
Journal article: 10.1039/D4DD00100A (DOI)

Software

Repository URL
https://github.com/ertekin-research-group/Dismai-Bench
Programming language
Python , Shell