Effects of Activation Barriers on Quenching to Stabilize Prebiotic Chemical Systems von Sheng, Qianyi, Intoy, Ben Fredrick, Halley, J W

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Mechanisms of lithium transport in amorphous polyethylene oxide von Duan, Yuhua, Halley, J W, Curtiss, Larry, Redfern, Paul

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Simulation methods for chemically specific modeling of electrochemical interfaces von Halley, J.W, Schelling, P, Duan, Y

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Ewald methods for polarizable surfaces with application to hydroxylation and hydrogen bonding on the (012) and (001) surfaces of α-Fe2O3 von WASSERMAN, E, RUSTAD, J. R, FELMY, A. R, HAY, B. P, HALLEY, J. W

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Molecular dynamics, density functional theory of the metal–electrolyte interface von Price, David L., Halley, J. W.

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A polarizable, dissociating molecular dynamics model for liquid water von HALLEY, J. W, RUSTAD, J. R, RAHMAN, A

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Scaling of the insulator-to-superconductor transition in ultrathin amorphous Bi films von LIU, Y, MCGREER, A, NEASE, B, HAVILAND, D. B, MARTINEZ, G, HALLEY, J. W, GOLDMAN, A. M

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Phonon mediated helium atom transmission through superfluid helium four von LIDKE, K. A, WYNVEEN, A, BAISCH, N, KOAY, C, GIESE, C. F, HALLEY, J. W

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Self consistent direct dynamics studies of interfaces von Halley, J W, Lin, Y, Zhuang, M

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Simulation of battery components and interfaces on the atomic scale: examples of what we can learn von Halley, J.W, Duan, Yuhua

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New approach to the observation of the condensate fraction in superfluid helium-4 von HALLEY, J. W, CAMPBELL, C. E, GIESE, C. F, GOETZ, K

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Relativistic tight-binding model: Application to Pt surfaces von Tchernatinsky, A., Halley, J. W.

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Gas dynamics of pulsed low energy helium beams von LIDKE, K. A, WILLIAMS, M. C, WYNVEEN, A, HALLEY, J. W

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Molecular dynamics study of the Cu-water interface in the presence of chlorine von ZHOU, Y, MAZZOLO, A, PRICE, D. L, HALLEY, J. W

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JAHN-TELLER EFFECT IN LIQUIDS - GENERAL-PRINCIPLES AND A MOLECULAR-DYNAMICS SIMULATION OF THE CUPRIC ION IN WATER von CURTISS, L, HALLEY, JW, WANG, XR

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Temperature dependence of the heterogeneous ferrous-ferric electron transfer reaction rate : comparison of experiment and theory von CURTISS, L. A, HALLEY, J. W, HAUTMAN, J, HUNG, N. C, NAGY, Z, RHEE, Y.-J, YONCO, R. M

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Atomic structure of solid and liquid polyethylene oxide von Johnson, J. A., Saboungi, M.-L., Price, D. L., Ansell, S., Russell, T. P., Halley, J. W., Nielsen, B.

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Theoretical issues in electronic structure of the passivation layer von Halley, J.W.

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Localization of polarons: A calculation in the adiabatic approximation von Schelling, P. K., Halley, J. W.

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Electronic Structure, Phonon Dynamical Properties, and Capture Capability of Na2-xMxZrO3 (M=Li,K): Density-Functional Calculations and Experimental Validations von Duan, Yuhua, Lekse, Jonathan, Wang, Xianfeng, Li, Bingyun, Alcántar-Vázquez, Brenda, Pfeiffer, Heriberto, Halley, J. W.

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