Published June 7, 2026 | Version v1
Dataset Open

MLIP Model and Dataset for "Coverage-Dependent Lateral Interactions Shape the Electrocatalytic Activity of High-Entropy Alloys""

Authors/Creators

  • 1. ROR icon Nankai University

Description

This repository provides the final MLIP model, the corresponding training dataset, and an example script demonstrating MLIP-based structural optimization.

Files

Files (167.9 MB)

Name Size
md5:2ba7227d83229997778372cccc30ad01
4.5 kB Download
md5:007f4f14a734cf570003737301d5a325
155.7 MB Download
md5:c5844a4e3366387f14ec3410254140ef
10.9 MB Download
md5:ff7159433b54119a6d22b742242d50c6
1.3 MB Download