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The last 5 uploaded publications
Accurate Binding Energies for Lithium Polysulfides and Assessment of Density Functionals for Lithium–Sulfur Battery Research
Qiu He, Xiaobin Liao, Lixue Xia, Zhaohuai Li, Huan Wang, Yan Zhao, Donald G Truhlar (2019). Accurate Binding Energies for Lithium Polysulfides and Assessment of Density Functionals for Lithium–Sulfur Battery Research. , 123(34), DOI: https://doi.org/10.1021/acs.jpcc.9b05235.
Article6 days agoMultistep Reaction Pathway for CO<sub>2</sub> Reduction on Hydride‐Capped Si Nanosheets
Lixue Xia, Xiaobin Liao, Qiu He, Huan Wang, Yan Zhao, Donald G Truhlar (2020). Multistep Reaction Pathway for CO<sub>2</sub> Reduction on Hydride‐Capped Si Nanosheets. , 12(3), DOI: https://doi.org/10.1002/cctc.201901105.
Article6 days agoExtrapolation of high-order correlation energies: the WMS model
Yan Zhao, Lixue Xia, Xiaobin Liao, Qiu He, Maria X. Zhao, Donald G Truhlar (2018). Extrapolation of high-order correlation energies: the WMS model. , 20(43), DOI: https://doi.org/10.1039/c8cp04973d.
Article6 days ago