Automated chemical kinetic modeling via hybrid reactive...

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Journal of Chemical Information and Modeling 2018 / 06

Automated chemical kinetic modeling via hybrid reactive molecular dynamics and quantum chemistry simulations

Döntgen, Malte, Schmalz, Felix, Kopp, Wassja A., Kröger, Leif C., Leonhard, Kai
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Language:
english
Journal:
Journal of Chemical Information and Modeling
DOI:
10.1021/acs.jcim.8b00078
Date:
June, 2018
File:
PDF, 1.09 MB
english, 2018
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