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Faraday Discussions|October 10, 2025
Optimising descriptors to correlate stability of C- or N-doped high-entropy alloys: a combined DFT and machine-learning regression studyChih-Heng Lee, Jyh-Wei Lee, Hsin-Yi Tiffany Chen
Journal of the American Chemical Society|April 29, 2024
Selective Orbital Coupling: An Adsorption Mechanism in Single-Atom CatalysisChen He, Chih-Heng Lee, Lei Meng, et al.
ACS Omega|April 19, 2021
The Effect of Degrees of Inversion on the Electronic Structure of Spinel NiCo2O4: A Density Functional Theory StudyTzu-Chien Chang, Yi-Ting Lu, Chih-Heng Lee, et al.
Advanced Materials (Deerfield Beach, Fla.)|December 20, 2024
A Library of Seed@High-Entropy-Alloy Core-shell Nanocrystals With Controlled Facets for CatalysisYueh-Chun Hsiao, Cheng-Yu Wu, Chih-Heng Lee, et al.
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