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Physical Chemistry Chemical Physics

High quality research in physical chemistry, chemical physics and biophysical chemistry.

Paper

Transition state geometry of driven chemical reactions on time-dependent double-well potentials

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Corresponding authors
a
Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, Georgia Institute of Technology, Atlanta, USA
E-mail: hernandez@gatech.edu
b
Department of Mathematical Sciences, Loughborough University, Loughborough LE11 3TU, UK
c
Grupo de Sistemas Complejos, Escuela Técnica Superior de Ingeniería Agronómica, Alimentaria y de Biosistemas, Universidad Politécnica de Madrid, Madrid, Spain
d
Instituto de Ciencias Matemáticas (ICMAT), Cantoblanco, Spain
e
Departamento de Química, Universidad Autónoma de Madrid, Cantoblanco, Spain
Phys. Chem. Chem. Phys., 2016,18, 30270-30281

DOI: 10.1039/C6CP02519F
Received 15 Apr 2016, Accepted 06 Jun 2016
First published online 06 Jun 2016

This article is part of themed collection: Insights from advanced methods in molecular dynamics
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