Index of extended abstracts, organized alphabetically by first author's last name, from:
Computation of Rates of Activated Processes
Symposium K of the Fall 1998 MRS meeting, Boston, Nov. 30-Dec. 2, 1998,
Tapio Ala-Nissila, NUMERICAL EVALUATION OF DIFFUSION COEFFICIENTS FOR STRONGLY INTERACTING SYSTEMS
Ali Alavi , Peijun Hu, CO OXIDATION ON Pt(111): AN AB INITIO DENSITY FUNCTIONAL THEORY STUDY
Scott M. Auerbach, KINETIC THEORY AND TRANSITION STATE SIMULATION OF DYNAMICS IN NANOPOROUS MATERIALS
S.V. Beiden and B.R. Cooper, MODELING OF INTERDIFFUSION OF PLUTONIUM AND OTHER METALS
Noam Bernstein, Michael J. Aziz, Efthimios Kaxiras, SIMULATIONS OF SOLID PHASE EPITAXIAL GROWTH IN SILICON
Emily A. Carter, SURFACE REACTION KINETICS FROM FIRST PRINCIPLES
D. Chandler, Peter Bolhuis and Christoph Dellago, FINDING TRANSITION PATHWAYS, THROWING ROPES OVER ROUGH MOUNTAIN PASSES, IN THE DARK
L. Y. Chen, S. C. Ying, EVALUATION OF JUMP RATES AND JUMP DISTANCES VIA PATH INTEGRAL FORMALISM
D.J. Doren, J.S. Hess, J.A. Barriocanal, A.C. Foraker, R. Konecny, PRINCIPLES OF CHEMISTRY ON THE Si(100) SURFACE FROM FIRST-PRINCIPLES CALCULATIONS
R. Du, A. Grosberg, and T. Tanaka, COEXISTENCE OF NATIVE AND DENATURED PHASES IN A SINGLE PROTEIN CHAIN
Timothy C. Germann and Arthur F. Voter, SIMULATION OF PHYSICAL VAPOR DEPOSITION USING COMBINED HYPERDYNAMICS AND PARALLEL REPLICA DYNAMICS
Sharon C. Glotzer and Claudio Donati, COOPERATIVE PARTICLE MOTION IN GLASS-FORMING LIQUIDS
Amit Gupta and Randall Q. Snurr, SIMULATION OF ACTIVATED MOLECULAR PASSING EVENTS IN ZEOLITE NANOPORES
J. C. Hamilton, APPLICATIONS OF TRANSITION FINDING TECHNIQUES TO ISLAND DIFFUSION ON SURFACES
Kenneth C. Hass, William F. Schneider, Alessandro Curioni, Wanda Andreoni, THE CHEMISTRY OF WATER ON ALUMINA SURFACES: REACTION DYNAMICS FROM FIRST PRINCIPLES
Roger Haydock, SOLVING LIOUVILLE'S EQUATION FOR THE RATES OF SLOW PROCESSES
J. Heinonen, I. Koponen, J. Merikoski and T. Ala-Nissila, DIFFUSION OF CU ISLANDS ON THE CU(100) SURFACE
R.G. Hoagland and R.J. Kurtz, AN APPLICATION OF ELASTIC BAND METHODS TO DETERMINE GRAIN BOUNDARY SLIDING RESISTANCE
Hannes Jonsson, METHODS FOR FINDING THE MECHANISM AND RATE OF SLOW TRANSITIONS
M. Kaukonen, J. Peräjoki, R. Nieminen, G. Jungnickel, T. Frauenheim, LOCALLY ACTIVATED MONTE CARLO (LAMC) METHOD FOR LONG TIME-SCALE SIMULATIONS
Efthimios Kaxiras, APPLICATIONS OF FIRST-PRINCIPLES AND EMPIRICAL METHODS IN DETERMINING ACTIVATED STATES AT SURFACES AND INTERFACES OF SILICON
J. Kieffer and B. J. Reardon, RATE PHENOMENA AND LYAPUNOV ANALYSIS OF ATOMIC TRAJECTORIES
Dmitry Kopelevich and Hsueh-Chia Chang, LATTICE VIBRATION-DRIVEN DIFFUSION THROUGH ZEOLITES
Nikolaos P. Kopsias and Doros N. Theodorou, ELEMENTARY STRUCTURAL TRANSITIONS IN A SIMPLE AMORPHOUS SOLID USING MULTIDIMENSIONAL TRANSITION-STATE THEORY
D. McKay, T. Kosugi and A.V. Granato, TUNNELING OF A STRING THROUGH A POTENTIAL BARRIER
Francesco Montalenti and Riccardo Ferrando, LONG JUMPS IN SURFACE DIFFUSION: THEORY AND SIMULATION
Normand Mousseau and Gerard T. Barkema, IDENTIFICATION OF ACTIVATED MECHANISMS IN COMPLEX MATERIALS USING THE ACTIVATION-RELAXATION TECHNIQUE
S. Mukherjee and B. R. Cooper, TRACE ELEMENT DIFFUSION IN BULK NiAl
S. Pal and K. A. Fichthorn, ACCELERATED MOLECULAR DYNAMICS OF RARE EVENTS
W. G. Rudd and A.F. Voter, HYPERDYNAMICS SIMULATIONS USING A SIMPLE BIAS POTENTIAL
Steven D. Schwartz, QUANTUM DYNAMICS IN CONDENSED PHASES - NEW APPROACHES AND APPLICATIONS
David S. Sholl, ACTIVATED TRANSPORT OF MOLECULAR CLUSTERS IN MOLECULAR SIEVE MICROPORES
Eunji Sim, Alexander Z. Patashinski and Mark A. Ratner, AMORPHIZATION IN PLANAR CLUSTERS
Mads R. Sørensen and Arthur F. Voter, TEMPERATURE-EXTRAPOLATED DYNAMICS: ACCELERATED SIMULATION OF RARE EVENTS
Roland Stumpf and Clarence Tracy, USE OF THE NUDGED ELASTIC BAND METHOD TO CALCULATE DIFFUSION PATHS IN METALS AND SEMICONDUCTORS
Kazuo Teraishi, S. Salai Cheettu Ammal, Aruba Yamada, Akira Endou, Momoji Kubo, and Akira Miyamoto, QUANTUM MOLECULAR DYNAMICS STUDY ON THE OXIDATION OF Si SURFACE
I. Vattulainen, MEMORY EFFECTS IN ARRHENIUS SURFACE DIFFUSION BARRIERS
Arthur F. Voter and Mads R. Sørensen, METHODS FOR EXTENDING THE TIME OF MOLECULAR DYNAMI CS SIMULATIONS OF DIFFUSIVE EVENTS IN MATERIALS
Michael C. Zerner, STUDIES ON THE INITIAL PHOTOCHEMICAL EVENT IN PHOTOSYNTHETIC SYSTEMS
Since Dec. 14, 1998, this page has been accessed
times.
Acknowledgment and Disclaimer