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Graeme Henkelman

Professor of Chemistry, University of Texas

E-mail confirmado em utexas.edu

Citado por 79390

computational chemistry catalysis transition state theory density functional theory

Jonas Björk

Linköping University

E-mail confirmado em liu.se

Citado por 6121

Surface chemistry Chemical reactions Transition state theory Density functional theory On-surface synthesis

Enrique Martinez

Clemson University

E-mail confirmado em clemson.edu

Citado por 4208

Computational Materials Science Materials under Extreme Conditions Monte Carlo Methods Transition State Theory

Thomas Bartsch

Senior Lecturer in Applied Mathematics, Loughborough University

E-mail confirmado em lboro.ac.uk

Citado por 1059

Dynamical Systems Transition State Theory Semiclassical Quantization

Stephan von Malottki

FNRS Fellow at Louvain-la-Neuve

E-mail confirmado em dartmouth.edu

Citado por 705

skyrmions magnetism spin-dynamics transition-state theory atomistic simulations

Panagiotis Kolokathis

NovaMechanics

E-mail confirmado em novamechanics.com

Citado por 375

Transition State theory Density Functional Theory Rietveld Refinement Atomistic Simulations

Elias Van Den Broeck

Ugent, CMM

E-mail confirmado em ugent.be

Citado por 271

Transition state theory dispersion interactions computational organic chemistry Molecular dynamics solvent models

Kevin Kelsey Brian Duff

Scientific Software Developer, Enthought UK

E-mail confirmado em enthought.com

Citado por 168

Computational Physics Theoretical Chemistry Density Functional Theory Transition State Theory Surface Science

Robin Bardakcioglu

Phd Student, University of Stuttgart

E-mail confirmado em itp1.uni-stuttgart.de

Citado por 125

Transition state theory

Mohammadhossein Nahavandian

Ph.D. Student in Mechanical Engineering at Clemson University

E-mail confirmado em clemson.edu

Citado por 15

Computational Material Science Transition State Theory Irradiation damage Complex Fluids