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1

Classically exact overlayer dynamics: Diffusion of rhodium clusters on Rh(100)

Voter, Arthur F.

Journal:

Physical Review B

Year:

1986

Language:

english

File:

PDF, 1.24 MB

english, 1986

2

Temperature-accelerated dynamics for simulation of infrequent events

So̸rensen, Mads R., Voter, Arthur F.

Journal:

The Journal of Chemical Physics

Year:

2000

Language:

english

File:

PDF, 582 KB

english, 2000

3

Accurate Interatomic Potentials for Ni, Al and Ni3Al

Voter, Arthur F., Chen, Shao Ping

Journal:

MRS Proceedings

Year:

1986

Language:

english

File:

PDF, 403 KB

english, 1986

4

Low-order moment expansions to tight binding for interatomic potentials: Successes and failures

Kress, Joel D., Voter, Arthur F.

Journal:

Physical Review B

Year:

1995

Language:

english

File:

PDF, 433 KB

english, 1995

5

Reflection and implantation of low energy helium with tungsten surfaces

Borovikov, Valery, Voter, Arthur F., Tang, Xian-Zhu

Journal:

Journal of Nuclear Materials

Year:

2014

Language:

english

File:

PDF, 1.79 MB

english, 2014

6

Diffusion mechanisms in Cu grain boundaries

Sørensen, Mads R., Mishin, Yuri, Voter, Arthur F.

Journal:

Physical Review B

Year:

2000

Language:

english

File:

PDF, 229 KB

english, 2000

7

Surface self-diffusion constants at low temperature: Monte Carlo transition state theory with importance sampling

Voter, Arthur F., Doll, Jimmie D.

Journal:

The Journal of Chemical Physics

Year:

1984

Language:

english

File:

PDF, 496 KB

english, 1984

8

Highly optimized empirical potential model of silicon

Lenosky, Thomas J, Sadigh, Babak, Alonso, Eduardo, Bulatov, Vasily V, Rubia, Tomas Diaz de la, Kim, Jeongnim, Voter, Arthur F, Kress, Joel D

Journal:

Modelling and Simulation in Materials Science and Engineering

Year:

2000

Language:

english

File:

PDF, 148 KB

english, 2000

9

TADSim

Mniszewski, Susan M., Junghans, Christoph, Voter, Arthur F., Perez, Danny, Eidenbenz, Stephan J.

Journal:

ACM Transactions on Modeling and Computer Simulation

Year:

2015

Language:

english

File:

PDF, 877 KB

english, 2015

10

Cluster analysis of accelerated molecular dynamics simulations: A case study of the decahedron to icosahedron transition in Pt nanoparticles

Huang, Rao, Lo, Li-Ta, Wen, Yuhua, Voter, Arthur F., Perez, Danny

Journal:

The Journal of Chemical Physics

Year:

2017

Language:

english

File:

PDF, 9.14 MB

english, 2017

11

Discovering mechanisms relevant for radiation damage evolution

Uberuaga, Blas Pedro, Martínez, Enrique, Perez, Danny, Voter, Arthur F.

Journal:

Computational Materials Science

Year:

2018

Language:

english

File:

PDF, 1.75 MB

english, 2018

12

An Overview of Recent Standard and Accelerated Molecular Dynamics Simulations of Helium Behavior in Tungsten

Sandoval, Luis, Perez, Danny, Uberuaga, Blas P., Voter, Arthur F.

Journal:

Year:

2019

Language:

english

File:

PDF, 14.15 MB

english, 2019

13

The isotope and temperature dependence of self-diffusion for hydrogen, deuterium, and tritium on Cu(100) in the 100–1000 K range

Steven M. Valone, Arthur F. Voter, Jimmie D. Doll

Journal:

Surface Science Letters

Year:

1985

Language:

english

File:

PDF, 48 KB

english, 1985

14

A method for describing resonance between generalized valence bond wavefunctions

Arthur F. Voter, William A. Goddard III

Journal:

Chemical Physics

Year:

1981

Language:

english

File:

PDF, 580 KB

english, 1981

15

Accelerated dynamics simulations of interstitial-cluster growth

Stefan Birner, Jeongnim Kim, David A. Richie, John W. Wilkins, Arthur F. Voter, Thomas Lenosky

Journal:

Solid State Communications

Year:

2001

Language:

english

File:

PDF, 179 KB

english, 2001

16

Structure and mobility of radiation-induced defects in MgO

Blas Pedro Uberuaga, Arthur F. Voter, Kurt E. Sickafus, Antony Cleave, Robin W. Grimes, Roger Smith

Journal:

Scientific Modeling and Simulation SMNS

Year:

2007

Language:

english

File:

PDF, 281 KB

english, 2007

17

Low-Speed Atomistic Simulation of Stick–Slip Friction using Parallel Replica Dynamics

Ashlie Martini, Yalin Dong, Danny Perez, Arthur F. Voter

Journal:

Tribology Letters

Year:

2009

Language:

english

File:

PDF, 504 KB

english, 2009

18

The Roles of Statics and Dynamics in Determining Transitions Between Atomic Friction Regimes

Yalin Dong, Danny Perez, Arthur F. Voter, Ashlie Martini

Journal:

Tribology Letters

Year:

2011

Language:

english

File:

PDF, 835 KB

english, 2011

19

Intraatomic exchange and the violation of Hund's rule in twisted ethylene

Arthur F. Voter, Marvin M. Goodgame, William A. Goddard III

Journal:

Chemical Physics

Year:

1985

Language:

english

File:

PDF, 775 KB

english, 1985

20

Reactive Bond-Order Simulations Using Both Spatial and Temporal Approaches to Parallelism

Steven J. Stuart, Yang Li, Oyeon Kum, J. W. Mintmire, Arthur F. Voter

Journal:

Structural Chemistry

Year:

2004

Language:

english

File:

PDF, 195 KB

english, 2004

21

Parallel replica dynamics for driven systems: Derivation and application to strained nanotubes

Uberuaga, Blas, Stuart, Steven, Voter, Arthur

Journal:

Physical Review B

Year:

2007

Language:

english

File:

PDF, 697 KB

english, 2007

22

Understanding the Surface Diffusion Processes during Magnetron Sputter-Deposition of Complex Oxide Mg–Al–O Thin Films

Georgieva, Violeta, Voter, Arthur F., Bogaerts, Annemie

Journal:

Crystal Growth & Design

Year:

2011

Language:

english

File:

PDF, 3.39 MB

english, 2011

23

EXTENDING THE TIME SCALE IN ATOMISTIC SIMULATION OF MATERIALS

Voter, Arthur F., Montalenti, Francesco, Germann, Timothy C.

Journal:

Annual Review of Materials Research

Year:

2002

Language:

english

File:

PDF, 1.22 MB

english, 2002

24

A method for accelerating the molecular dynamics simulation of infrequent events

Voter, Arthur F.

Journal:

The Journal of Chemical Physics

Year:

1997

Language:

english

File:

PDF, 411 KB

english, 1997

25

First-principles investigation of radiation induced defects in Si and SiC

Wolfgang Windl, Thomas J Lenosky, Joel D Kress, Arthur F Voter

Journal:

Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms

Year:

1998

Language:

english

File:

PDF, 98 KB

english, 1998

26

Hyperdynamics: Accelerated Molecular Dynamics of Infrequent Events

Journal:

Physical Review Letters

Year:

1997

Language:

english

File:

PDF, 231 KB

english, 1997

27

Convergence of surface diffusion parameters with model crystal size

Jennifer M. Cohen, Arthur F. Voter

Journal:

Surface Science

Year:

1994

Language:

english

File:

PDF, 887 KB

english, 1994

28

Fullerene and graphene formation from carbon nanotube fragments

Blas P. Uberuaga, Steven J. Stuart, Wolfgang Windl, Michael P. Masquelier, Arthur F. Voter

Journal:

Computational and Theoretical Chemistry

Year:

2012

Language:

english

File:

PDF, 1.29 MB

english, 2012

29

Highly optimized tight-binding model of silicon

Lenosky, Thomas J., Kress, Joel D., Kwon, Inhee, Voter, Arthur F., Edwards, Byard, Richards, David F., Yang, Sang, Adams, James B.

Journal:

Physical Review B

Year:

1997

Language:

english

File:

PDF, 231 KB

english, 1997

30

Diffusion in Crystalline

Uberuaga, Blas P., Voter, Arthur F., Sieber, Kurt Ken, Sholl, David S.

Journal:

Physical Review Letters

Year:

2003

Language:

english

File:

PDF, 124 KB

english, 2003

31

The isotope and temperature dependence of self-diffusion for hydrogen, deuterium, and tritium on Cu(100) in the 100–1000 K range

Steven M Valone, Arthur F Voter, Jimmie D Doll

Journal:

Surface Science

Year:

1985

Language:

english

File:

PDF, 823 KB

english, 1985

32

Transition state theory description of surface self-diffusion: Comparison with classical trajectory results

Voter, Arthur F., Doll, Jimmie D.

Journal:

The Journal of Chemical Physics

Year:

1984

Language:

english

File:

PDF, 762 KB

english, 1984

33

Dynamical corrections to transition state theory for multistate systems: Surface self-diffusion in the rare-event regime

Voter, Arthur F., Doll, Jimmie D.

Journal:

The Journal of Chemical Physics

Year:

1985

Language:

english

File:

PDF, 1.27 MB

english, 1985

34

Method to account for arbitrary strains in kinetic Monte Carlo simulations

Subramanian, Gopinath, Perez, Danny, Uberuaga, Blas P., Tomé, Carlos N., Voter, Arthur F.

Journal:

Physical Review B

Year:

2013

Language:

english

File:

PDF, 1.45 MB

english, 2013

35

Scalable kernel polynomial method for calculating transition rates

Huang, Chen, Voter, Arthur F., Perez, Danny

Journal:

Physical Review B

Year:

2013

Language:

english

File:

PDF, 1022 KB

english, 2013

36

Coupled motion of grain boundaries in bcc tungsten as a possible radiation-damage healing mechanism under fusion reactor conditions

Borovikov, Valery, Tang, Xian-Zhu, Perez, Danny, Bai, Xian-Ming, Uberuaga, Blas P., Voter, Arthur F.

Journal:

Year:

2013

Language:

english

File:

PDF, 395 KB

english, 2013

37

Accurate acceleration of kinetic Monte Carlo simulations through the modification of rate constants

Chatterjee, Abhijit, Voter, Arthur F.

Journal:

The Journal of Chemical Physics

Year:

2010

Language:

english

File:

PDF, 1.74 MB

english, 2010

38

Parallel replica method for dynamics of infrequent events

Voter, Arthur F.

Journal:

Physical Review B

Year:

1998

Language:

english

File:

PDF, 63 KB

english, 1998

39

Molecular-dynamics simulations of two-dimensional materials at high strain rates

Wagner, Norman J., Holian, Brad Lee, Voter, Arthur F.

Journal:

Physical Review A

Year:

1992

Language:

english

File:

PDF, 772 KB

english, 1992

40

Calculation of point-defect entropy in metals

Mishin, Yuri, S⊘rensen, Mads R., Voter, Arthur F.

Journal:

Philosophical Magazine A

Year:

2001

Language:

english

File:

PDF, 1.19 MB

english, 2001

41

Compact surface-cluster diffusion by concerted rotation and translation

Hamilton, J. C., Sørensen, Mads R., Voter, Arthur F.

Journal:

Physical Review B

Year:

2000

Language:

english

File:

PDF, 243 KB

english, 2000

42

The generalized resonating valence bond description of cyclobutadiene

Voter, Arthur F., Goddard, William A.

Journal:

Journal of the American Chemical Society

Year:

1986

Language:

english

File:

PDF, 951 KB

english, 1986

43

Role of atomic structure on grain boundary-defect interactions in Cu

Bai, Xian-Ming, Vernon, Louis J., Hoagland, Richard G., Voter, Arthur F., Nastasi, Michael, Uberuaga, Blas Pedro

Journal:

Physical Review B

Year:

2012

Language:

english

File:

PDF, 5.60 MB

english, 2012

44

Sublattice parallel replica dynamics

Martínez, Enrique, Uberuaga, Blas P., Voter, Arthur F.

Journal:

Physical Review E

Year:

2014

Language:

english

File:

PDF, 1.23 MB

english, 2014

45

Synchronization of trajectories in canonical molecular-dynamics simulations: Observation, explanation, and exploitation

Uberuaga, Blas P., Anghel, Marian, Voter, Arthur F.

Journal:

The Journal of Chemical Physics

Year:

2004

Language:

english

File:

PDF, 368 KB

english, 2004

46

Entropic Stabilization of Nanoscale Voids in Materials under Tension

Perez, Danny, Luo, Sheng-Nian, Voter, Arthur F., Germann, Timothy C.

Journal:

Physical Review Letters

Year:

2013

Language:

english

File:

PDF, 884 KB

english, 2013

47

Influence of point defects on grain boundary mobility in bcc tungsten

Borovikov, Valery, Tang, Xian-Zhu, Perez, Danny, Bai, Xian-Ming, Uberuaga, Blas P, Voter, Arthur F

Journal:

Journal of Physics Condensed Matter

Year:

2013

Language:

english

File:

PDF, 916 KB

english, 2013

48

Insights into Microscopic Diffusion Processes at a Solid/Fluid Interface under Supercritical Conditions: A Study of the Aqueous Calcite (101̅4) Surface

Lu, Chun-Yaung, Perez, Danny, Hickmott, Donald D., Voter, Arthur F.

Journal:

The Journal of Physical Chemistry C

Year:

2012

Language:

english

File:

PDF, 1.83 MB

english, 2012

49

Bad Seeds Sprout Perilous Dynamics: Stochastic Thermostat Induced Trajectory Synchronization in Biomolecules

Sindhikara, Daniel J., Kim, Seonah, Voter, Arthur F., Roitberg, Adrian E.

Journal:

Journal of Chemical Theory and Computation

Year:

2009

Language:

english

File:

PDF, 2.52 MB

english, 2009

50

Growth

Shim, Yunsic, Borovikov, Valery, Uberuaga, Blas P., Voter, Arthur F., Amar, Jacques G.

Journal:

Physical Review Letters

Year:

2008

Language:

english

File:

PDF, 632 KB

english, 2008