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18 Publications
2023 | Journal Article | IST-REx-ID: 14605
Ouyang N, Zeng Z, Wang C, Wang Q, Chen Y. Role of high-order lattice anharmonicity in the phonon thermal transport of silver halide AgX (X=Cl,Br, I). Physical Review B. 2023;108(17). doi:10.1103/PhysRevB.108.174302
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| DOI
2023 | Journal Article | IST-REx-ID: 14603 | 
Reinhardt A, Chew PY, Cheng B. A streamlined molecular-dynamics workflow for computing solubilities of molecular and ionic crystals. Journal of Chemical Physics. 2023;159(18). doi:10.1063/5.0173341
[Published Version]
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| arXiv
2023 | Research Data Reference | IST-REx-ID: 14619 |
Cheng B. BingqingCheng/solubility: V1.0. 2023. doi:10.5281/ZENODO.8398094
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2023 | Journal Article | IST-REx-ID: 14425 |
Zeng Z, Wodaczek F, Liu K, et al. Mechanistic insight on water dissociation on pristine low-index TiO2 surfaces from machine learning molecular dynamics simulations. Nature Communications. 2023;14. doi:10.1038/s41467-023-41865-8
[Published Version]
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| PubMed | Europe PMC
| arXiv
2022 | Journal Article | IST-REx-ID: 10827 |
Lee JG, Pickard CJ, Cheng B. High-pressure phase behaviors of titanium dioxide revealed by a Δ-learning potential. The Journal of chemical physics. 2022;156(7). doi:10.1063/5.0079844
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