Nitromethane Decomposition via Automated Reaction Discovery and an Ab Initio Corrected Kinetic Model-Reference-Cited by-同舟云学术

Nitromethane Decomposition via Automated Reaction Discovery and an Ab Initio Corrected Kinetic Model

Published:2021-02-11 Issue:7 Volume:125 Page:1447-1460
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Ford Jason¹²,Seritan Stefan¹²^ORCID,Zhu Xiaolei¹²^ORCID,Sakano Michael N.³^ORCID,Islam Md Mahbub³⁴^ORCID,Strachan Alejandro³,Martínez Todd J.¹²^ORCID

Affiliation:

1. Department of Chemistry and The PULSE Institute, Stanford University, Stanford, California 94305, United States

2. SLAC National Accelerator Laboratory, 2575 Sand Hill Road, Menlo Park, California 94025, United States

3. School of Materials Engineering and Birck Nanotechnology Center, Purdue University, West Lafayette, Indiana 47907, United States

4. Department of Mechanical Engineering, Wayne State University, Detroit, Michigan 48202, United States

Funder

Division of Graduate Education

Office of Naval Research

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.0c09168

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5. Smith, G. P.; Golden, D. M.; Frenklach, M.; Moriarty, N. W.; Eiteneer, B.; Goldenberg, M.; Bowman, C. T.; Hanson, R. K.; Song, S.; Gardiner, W. C., Jr.; GRI-Mech 3.0. http://combustion.berkeley.edu/gri-mech/version30/text30.html.

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