| Acidity of edge surface sites of montmorillonite and kaolinite X Liu, X Lu, M Sprik, J Cheng, EJ Meijer, R Wang Geochimica et Cosmochimica Acta 117, 180-190, 2013 | 224 | 2013 |
| Redox potentials and acidity constants from density functional theory based molecular dynamics J Cheng, X Liu, J VandeVondele, M Sulpizi, M Sprik Accounts of Chemical Research 47 (12), 3522-3529, 2014 | 193 | 2014 |
| A thermodynamic understanding of clay-swelling inhibition by potassium ions XD Liu, XC Lu ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH- 45 (38), 6300, 2006 | 182 | 2006 |
| Surface wettability of basal surfaces of clay minerals: insights from molecular dynamics simulation L Zhang, X Lu, X Liu, K Yang, H Zhou Energy & Fuels 30 (1), 149-160, 2016 | 119 | 2016 |
| Hydration and Mobility of Interlayer Ions of (Nax, Cay)-Montmorillonite: A Molecular Dynamics Study HZ Lihu Zhang, Xiancai Lu*, Xiandong Liu, Jinhong Zhou J. Phys. Chem. C, 118 (51), 29811–29821, 2014 | 113* | 2014 |
| Aligning Electronic and Protonic Energy Levels of Proton‐Coupled Electron Transfer in Water Oxidation on Aqueous TiO2 J Cheng, X Liu, JA Kattirtzi, J VandeVondele, M Sprik Angewandte Chemie 126 (45), 12242-12246, 2014 | 93 | 2014 |
| Effects of layer-charge distribution on the thermodynamic and microscopic properties of Cs-smectite X Liu, X Lu, R Wang, H Zhou Geochimica et Cosmochimica Acta 72 (7), 1837-1847, 2008 | 90 | 2008 |
| Surface acidity of 2: 1-type dioctahedral clay minerals from first principles molecular dynamics simulations X Liu, J Cheng, M Sprik, X Lu, R Wang Geochimica et Cosmochimica Acta 140, 410-417, 2014 | 85 | 2014 |
| Interlayer structure and dynamics of alkylammonium-intercalated smectites with and without water: A molecular dynamics study X Liu, X Lu, R Wang, H Zhou, S Xu Clays and Clay Minerals 55 (6), 554-564, 2007 | 82 | 2007 |
| Understanding surface acidity of gibbsite with first principles molecular dynamics simulations X Liu, J Cheng, M Sprik, X Lu, R Wang Geochimica et Cosmochimica Acta 120, 487-495, 2013 | 75 | 2013 |
| Atomic-scale structures of interfaces between phyllosilicate edges and water X Liu, X Lu, EJ Meijer, R Wang, H Zhou Geochimica et Cosmochimica Acta 81, 56-68, 2012 | 73 | 2012 |
| Atomic scale structures of interfaces between kaolinite edges and water X Liu, X Lu, R Wang, EJ Meijer, H Zhou, H He Geochimica et Cosmochimica Acta 92, 233-242, 2012 | 70 | 2012 |
| Surface acidity of quartz: Understanding the crystallographic control X Liu, J Cheng, X Lu, R Wang Physical Chemistry Chemical Physics 16 (48), 26909-26916, 2014 | 69 | 2014 |
| Surface complexation of heavy metal cations on clay edges: insights from first principles molecular dynamics simulation of Ni (II) C Zhang, X Liu, X Lu, M He, EJ Meijer, R Wang Geochimica et Cosmochimica Acta 203, 54-68, 2017 | 67 | 2017 |
| Molecular dynamics insight into the cointercalation of hexadecyltrimethyl-ammonium and acetate ions into smectites X Liu, X Lu, R Wang, H Zhou, S Xu American Mineralogist 94 (1), 143-150, 2009 | 60 | 2009 |
| Molecular-level understanding of metal ion retention in clay-rich materials X Liu, C Tournassat, S Grangeon, AG Kalinichev, Y Takahashi, ... Nature Reviews Earth & Environment 3 (7), 461-476, 2022 | 56 | 2022 |
| Hydration of methane intercalated in Na-smectites with distinct layer charge: Insights from molecular simulations Q Zhou, X Lu, X Liu, L Zhang, H He, J Zhu, P Yuan Journal of colloid and interface science 355 (1), 237-242, 2011 | 56 | 2011 |
| Hydration mechanisms of Cu2+: tetra-, penta-or hexa-coordinated? X Liu, X Lu, EJ Meijer, R Wang Physical Chemistry Chemical Physics 12 (36), 10801-10804, 2010 | 55 | 2010 |
| Sorption and desorption of phenanthrene onto iron, copper, and silicon dioxide nanoparticles J Fang, X Shan, B Wen, J Lin, X Lu, X Liu, G Owens Langmuir 24 (19), 10929-10935, 2008 | 51 | 2008 |
| Mechanistic understanding of uranyl ion complexation on montmorillonite edges: a combined first-principles molecular dynamics–surface complexation modeling approach C Zhang, X Liu, RM Tinnacher, C Tournassat Environmental science & technology 52 (15), 8501-8509, 2018 | 49 | 2018 |
Jun Cheng (程俊）Xiamen UniversityVerified email at xmu.edu.cn
