Using reduced density matrix techniques to capture static and dynamic correlation in the energy landscape for the decomposition of the CH2CH2ONO radical and support a non-IRC pathway-Reference-Cited by-同舟云学术

Using reduced density matrix techniques to capture static and dynamic correlation in the energy landscape for the decomposition of the CH2CH2ONO radical and support a non-IRC pathway

Published:2018-07-14 Issue:2 Volume:149 Page:024302
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Smart Scott E.¹^ORCID,Scrape Preston G.¹,Butler Laurie J.¹,Mazziotti David A.¹

Affiliation:

1. The James Franck Institute and Department of Chemistry, The University of Chicago, Chicago, Illinois 60637, USA

Funder

Division of Chemistry

Army Research Office

Air Force Office of Scientific Research

Basic Energy Sciences

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/am-pdf/10.1063/1.5024512

Reference57 articles.

1. Dynamics of photodissociation of hono at 369 nm: Motional anisotropy and internal state distribution of the OH fragment

2. Photoinduced Bimolecular Reactions in Homogeneous [CH3ONO]n Clusters

3. Photodissociation of methylnitrite: State distributions, recoil velocity distribution, and alignment effects of the NO(X 2Π) photofragment

4. Conformers and Photochemistry of Propyl Nitrites: A Matrix Isolation Study

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