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18 Publications


2023 | Journal Article | IST-REx-ID: 14605
Ouyang, Niuchang, Zezhu Zeng, Chen Wang, Qi Wang, and Yue Chen. “Role of High-Order Lattice Anharmonicity in the Phonon Thermal Transport of Silver Halide AgX (X=Cl,Br, I).” Physical Review B. American Physical Society, 2023. https://doi.org/10.1103/PhysRevB.108.174302.
View | DOI
 

2023 | Journal Article | IST-REx-ID: 14603 | OA
Reinhardt, Aleks, Pin Yu Chew, and Bingqing Cheng. “A Streamlined Molecular-Dynamics Workflow for Computing Solubilities of Molecular and Ionic Crystals.” Journal of Chemical Physics. AIP Publishing, 2023. https://doi.org/10.1063/5.0173341.
[Published Version] View | Files available | DOI | arXiv
 

2023 | Research Data Reference | IST-REx-ID: 14619 | OA
Cheng, Bingqing. “BingqingCheng/Solubility: V1.0.” Zenodo, 2023. https://doi.org/10.5281/ZENODO.8398094.
[Published Version] View | Files available | DOI | Download Published Version (ext.)
 

2023 | Journal Article | IST-REx-ID: 14425 | OA
Zeng, Zezhu, Felix Wodaczek, Keyang Liu, Frederick Stein, Jürg Hutter, Ji Chen, and Bingqing Cheng. “Mechanistic Insight on Water Dissociation on Pristine Low-Index TiO2 Surfaces from Machine Learning Molecular Dynamics Simulations.” Nature Communications. Springer Nature, 2023. https://doi.org/10.1038/s41467-023-41865-8.
[Published Version] View | Files available | DOI | WoS | PubMed | Europe PMC | arXiv
 

2022 | Journal Article | IST-REx-ID: 10827 | OA
Lee, Jacob G., Chris J. Pickard, and Bingqing Cheng. “High-Pressure Phase Behaviors of Titanium Dioxide Revealed by a Δ-Learning Potential.” The Journal of Chemical Physics. AIP Publishing, 2022. https://doi.org/10.1063/5.0079844.
[Preprint] View | DOI | Download Preprint (ext.) | WoS | arXiv
 

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