JARVIS_TinNet_N
收藏DataCite Commons2024-03-28 更新2025-04-09 收录
下载链接:
https://materials.colabfit.org/id/DS_ffsgl0wufoft_0
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资源简介:
The JARVIS_TinNet dataset is part of the joint automated repository for various integrated simulations (JARVIS) database. This dataset contains configurations from the TinNet-N dataset: a collection assembled to train a machine learning model for the purposes of assisting catalyst design by predicting chemical reactivity of transition-metal surfaces. The adsorption systems contained in this dataset consist of {100}-terminated Pt-based bimetallic surfaces doped with a third element. JARVIS is a set of tools and collected datasets built to meet current materials design challenges.
提供机构:
ColabFit
创建时间:
2024-03-28



