Skip to content
Log in
Sponsored AI AM CLAUDE, A Beginner's Guide: Learn the basics of working with AI AI AM CLAUDE, A Beginner's Guide: Learn the basics of working with AI

Author

Bo-Wen Deng

View on Semantic Scholar

2 papers indexed here

We haven’t gathered this author’s papers yet. Follow them and we’ll fetch their work.

Not the right person? Other researchers publish under this name.

Preprint Aug 2026

Universal Thermodynamic Interatomic Potentials for Crystalline Materials

Free energies govern solid-state phase stability, yet computational materials discovery still relies largely on ground-state energies because free energy calculations require ensemble averages. We introduce the thermodynamic interatomic potential (TIP), which extends an interatomic potential from its static energy to a...

Juno Nam, Bo-Wen Deng, Xiaochen Du et al. · 0 citations
Aug 2026

MLIP-Enhanced Thermochemistry Predictions across Organic Chemical Space

This work presents thermoMLIP, a machine-learning-interatomic-potential-based workflow for efficient conformer optimization and thermochemistry prediction across the organic chemical space. By combining MLIP-driven geometry optimization with robust thermochemical corrections, thermoMLIP achieves near-DFT accuracy at...

Bo-Wen Deng, T. Stuyver · 0 citations

We use cookies to run the site and, with your consent, for analytics and to show ads. See our Cookie Policy.