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Role of Metal-Lithium Oxide Interfaces in the Extra Lithium Capacity of Metal Oxide Lithium-Ion Battery Anode Materials Ranganath SB, Hassan AS, Ramachandran BR, Wick CD Journal of the Electrochemical Society, 163(10), A2172, 2016 |
2 |
Effect of surface oxidation on interfacial water structure at a pyrite (100) surface as studied by molecular dynamics simulation Jin JQ, Miller JD, Dang LX, Wick CD International Journal of Mineral Processing, 139, 64, 2015 |
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Effect of Cu2+ activation on interfacial water structure at the sphalerite surface as studied by molecular dynamics simulation Jin JQ, Miller JD, Dang LX, Wick CD International Journal of Mineral Processing, 145, 66, 2015 |
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Bringing Reactivity to the Aggregation-Volume-Bias Monte Carlo Based Simulation Framework: Water Nucleation Induced by a Reactive Proton Kumar R, Knight C, Wick CD, Chen B Journal of Physical Chemistry B, 119(29), 9068, 2015 |
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Computational Observation of Pockets of Enhanced Water Concentration at the 1-Octanol/Water Interface Wick CD, Chang TM Journal of Physical Chemistry B, 118(28), 7785, 2014 |
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Computational study on the effect of alkyl chain length on alkane-water interfacial width Cummings OT, Wick CD Chemical Physics Letters, 556, 65, 2013 |
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HCl Accommodation, Dissociation, and Propensity for the Surface of Water Wick CD Journal of Physical Chemistry A, 117(47), 12459, 2013 |
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Transferable Potentials for Phase Equilibria-United Atom Description of Five- and Six-Membered Cyclic Alkanes and Ethers Keasler SJ, Charan SM, Wick CD, Economou IG, Siepmann JI Journal of Physical Chemistry B, 116(36), 11234, 2012 |
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Computational Investigation on the Effect of Alumina Hydration on Lithium Ion Mobility in Poly(ethylene oxide) LiClO4 Electrolytes Wu H, Cummings OT, Wick CD Journal of Physical Chemistry B, 116(51), 14922, 2012 |
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Molecular mechanism of hydrocarbons binding to the metal-organic framework Sun XQ, Wick CD, Thallapally PK, McGrail BP, Dang LX Chemical Physics Letters, 501(4-6), 455, 2011 |