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18 Publications

2023 | Journal Article | IST-REx-ID: 14605
Ouyang, N., Zeng, Z., Wang, C., Wang, Q., & Chen, Y. (2023). 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. https://doi.org/10.1103/PhysRevB.108.174302
View | DOI
 
2023 | Journal Article | IST-REx-ID: 14603 | OA
Reinhardt, A., Chew, P. Y., & Cheng, B. (2023). A streamlined molecular-dynamics workflow for computing solubilities of molecular and ionic crystals. Journal of Chemical Physics. AIP Publishing. https://doi.org/10.1063/5.0173341
[Published Version] View | Files available | DOI | arXiv
 
2023 | Research Data Reference | IST-REx-ID: 14619 | OA
Cheng, B. (2023). BingqingCheng/solubility: V1.0. Zenodo. 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, Z., Wodaczek, F., Liu, K., Stein, F., Hutter, J., Chen, J., & Cheng, B. (2023). Mechanistic insight on water dissociation on pristine low-index TiO2 surfaces from machine learning molecular dynamics simulations. Nature Communications. Springer Nature. 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, J. G., Pickard, C. J., & Cheng, B. (2022). High-pressure phase behaviors of titanium dioxide revealed by a Δ-learning potential. The Journal of Chemical Physics. AIP Publishing. https://doi.org/10.1063/5.0079844
[Preprint] View | DOI | Download Preprint (ext.) | WoS | arXiv
 

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