Arthur F. Voter

Representative Publications


"Structure and Mobility of Defects Formed from Collision Cascades in MgO," B.P. Uberuaga, R. Smith, A.R. Cleave, F. Montalenti, G. Henkelman, R.W. Grimes, A.F. Voter, and K.E. Sickafus, Phys. Rev. Lett. 92 , 115505 (2004).

``Parallel Replica Dynamics with a Heterogeneous Distribution of Barriers: Application to n-Hexadecane Pyrolysis," O. Kum, ZB.M. Dickson, S.J. Stuart, B.P. Uberuaga, and A.F. Voter, J. Chem. Phys. 121, 10346 (2004).

"Synchronization of trajectories in canonical molecular-dynamics simulations: Observation, explanation, and exploitation," B.P. Uberuaga, M. Anghel, and A.F. Voter, J. Chem. Phys. 120, 6363 (2004).

"Extending the Time Scale in Atomistic Simulation of Materials," A.F. Voter, F. Montalenti and T.C. Germann, Annu. Rev. Mater. Res., 32, 321 (2002). PDF file (1.2Mb)

"Closing the gap between experiment and theory: Crystal growth by temperature accelerated dynamics," F. Montalenti, M.R. Sorensen and A.F. Voter, Phys. Rev. Lett. 87, 126101 (2001).

"Temperature-accelerated dynamics for simulation of infrequent events," M.R. Sorensen and A.F. Voter, J. Chem. Phys. 112, 9599 (2000).

"Parallel Replica Method for Dynamics of Infrequent Events," A.F. Voter, Phys. Rev. B 57, 13985 (1998).

"Hyperdynamics: Accelerated Molecular Dynamics of Infrequent Events," A.F. Voter, Phys. Rev. Lett., 78, 3908 (1997).

"A Method for Accelerating the Molecular Dynamics Simulation of Infrequent Events," A.F. Voter, J. Chem. Phys. 106, 4665 (1997).

"Linear-scaling Tight Binding from a Truncated Moment Approach," A.F. Voter, J.D. Kress, and R.N. Silver, Phys. Rev. B. 53, 12733 (1996).

"Interatomic Potentials for Materials Simulation: Progress and Perspectives," MRS Bulletin, edited by A.F. Voter, 21, 17 (1996).

"The Embedded Atom Method," A.F. Voter, in "Intermetallic Compounds: Principles and Practice," edited by J.H. Westbrook and R.L. Fleischer, John Wiley and Sons, Ltd, 1994, p. 77.

"Surface Diffusion Modes for Pt Dimers and Trimers on Pt(001)," G.L. Kellogg and A.F. Voter, Phys. Rev. Lett., 67, 622 (1991).

"EAM Study of Surface Self-Diffusion of Single Adatoms of FCC Metals Ni, Cu, Al, Ag, Au, Pd, and Pt," C.L. Liu, J.M. Cohen, J.B. Adams, and A.F. Voter, Surf. Sci., 253, 334 (1991).

"Computing Classically Exact Diffusion Constants Using Short Time Trajectories," A.F. Voter, Phys. Rev. Lett. 63, 167 (1989).

"Classically Exact Overlayer Dynamics: Diffusion of Rhodium Clusters on Rh(100)," A.F. Voter, Phys. Rev. B 34, 6819 (1986).

"A Monte Carlo Method for Determining Free-Energy Differences and Transition State Theory Rate Constants," A.F. Voter, J. Chem. Phys. 82, 1890 (1985).

"Dynamical Corrections to Transition State Theory for Multistate Systems: Surface Self-Diffusion in the Rare-Event Regime," A.F. Voter and J.D. Doll, J. Chem. Phys. 82, 80 (1985). PDF file (2.3Mb)


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