Acidity of edge surface sites of montmorillonite and kaolinite von Liu, Xiandong, Lu, Xiancai, Sprik, Michiel, Cheng, Jun, Meijer, Evert Jan, Wang, Rucheng

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Redox Potentials and Acidity Constants from Density Functional Theory Based Molecular Dynamics von Cheng, Jun, Liu, Xiandong, VandeVondele, Joost, Sulpizi, Marialore, Sprik, Michiel

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A combined first principles and classical molecular dynamics study of clay-soil organic matters (SOMs) interactions von Zhang, Yingchun, Liu, Xiandong, Zhang, Chi, Lu, Xiancai

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Noble gas (He, Ne, and Ar) solubilities in high-pressure silicate melts calculated based on deep-potential modeling von Wang, Kai, Lu, Xiancai, Liu, Xiandong, Yin, Kun

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Surface acidity of 2:1-type dioctahedral clay minerals from first principles molecular dynamics simulations von Liu, Xiandong, Cheng, Jun, Sprik, Michiel, Lu, Xiancai, Wang, Rucheng

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Partitioning of noble gases (He, Ne, Ar, Kr, Xe) during Earth’s core segregation: A possible core reservoir for primordial noble gases von Wang, Kai, Lu, Xiancai, Liu, Xiandong, Zhou, Mengzi, Yin, Kun

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Surface complexation of heavy metal cations on clay edges: insights from first principles molecular dynamics simulation of Ni(II) von Zhang, Chi, Liu, Xiandong, Lu, Xiancai, He, Mengjia, Jan Meijer, Evert, Wang, Rucheng

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Molecular dynamics simulation of alkylammonium-intercalated vermiculites von Chen Cheng, Chen Cheng, Liu Xiandong, Liu Xiandong, Zhang Yingchun, Zhang Yingchun, Zhang Chi, Zhang Chi, Lu Xiancai, Lu Xiancai

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Cadmium(II) complexes adsorbed on clay edge surfaces; insight from first principles molecular dynamics simulation von Zhang Chi, Zhang Chi, Liu Xiandong, Liu Xiandong, Lu Xiancai, Lu Xiancai, Meijer, Evert Jan, Wang Kai, Wang Kai, He Mengjia, He Mengjia, Wang Rucheng, Wang Rucheng

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A molecular dynamics study of Li speciation in hydrothermal fluids and silicate melts von Wang, Tianhua, Zhang, Xiaoyu, Liu, Xiandong, Lu, Xiancai, Wang, Rucheng

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Understanding surface acidity of gibbsite with first principles molecular dynamics simulations von Liu, Xiandong, Cheng, Jun, Sprik, Michiel, Lu, Xiancai, Wang, Rucheng

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Sn(II) chloride speciation and equilibrium Sn isotope fractionation under hydrothermal conditions: A first principles study von Wang, Tianhua, She, Jia-Xin, Yin, Kun, Wang, Kai, Zhang, Yingjie, Lu, Xiancai, Liu, Xiandong, Li, Weiqiang

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Lithium partition and isotopic fractionation for cation exchange in clay: Insights from molecular simulations von Li, Qin, Lu, Xiancai, Chen, Meng, Zhang, Lihu, Cheng, Yongxian, Liu, Xiandong, Yin, Zhe

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Interfacial structures and acidity of edge surfaces of ferruginous smectites von Liu, Xiandong, Cheng, Jun, Sprik, Michiel, Lu, Xiancai, Wang, Rucheng

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Preface to Multiscale Simulation in Geochemistry von Liu, Xiandong, Tournassat, Christophe, Steefel, Carl I.

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Construction of road roughness in left and right wheel paths based on PSD and coherence function von Liu, Xiandong, Wang, Haixia, Shan, Yingchun, He, Tian

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Inhibition of EZH2 prevents acute respiratory distress syndrome (ARDS)-associated pulmonary fibrosis by regulating the macrophage polarization phenotype von Bao, Xiaowei, Liu, Xiandong, Liu, Na, Zhuang, Shougang, Yang, Qian, Ren, Huijuan, Zhao, Dongyang, Bai, Jianwen, Zhou, Xiaohui, Tang, Lunxian

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Surface acidity of quartz: understanding the crystallographic control von Liu, Xiandong, Cheng, Jun, Lu, Xiancai, Wang, Rucheng

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Aligning Electronic and Protonic Energy Levels of Proton-Coupled Electron Transfer in Water Oxidation on Aqueous TiO2 von Cheng, Jun, Liu, Xiandong, Kattirtzi, John A., VandeVondele, Joost, Sprik, Michiel

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Complexation of heavy metal cations on clay edges at elevated temperatures von Zhang, Chi, Liu, Xiandong, Lu, Xiancai, He, Mengjia

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