First-principles–based reaction kinetics from reactive molecular dynamics simulations: Application to hydrogen peroxide decomposition
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Title
First-principles–based reaction kinetics from reactive molecular dynamics simulations: Application to hydrogen peroxide decomposition
Authors
Keywords
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Journal
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
Volume -, Issue -, Pages 201701383
Publisher
Proceedings of the National Academy of Sciences
Online
2018-09-22
DOI
10.1073/pnas.1701383115
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