Detecting reactive islands using Lagrangian descriptors and the relevance to transition path sampling-Reference-Cited by-同舟云学术

Detecting reactive islands using Lagrangian descriptors and the relevance to transition path sampling

Published:2018 Issue:7 Volume:20 Page:4970-4981
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Patra Sarbani¹²³⁴,Keshavamurthy Srihari¹²³⁴^ORCID

Affiliation:

1. Department of Chemistry

2. Indian Institute of Technology

3. Kanpur

4. India

Abstract

Lagrangian descriptors are used to detect the reactive islands in the phase space of the two dimensional Müller–Brown potential model for an isomerization reaction.

Funder

Indian Institute of Technology Kanpur

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2018/CP/C7CP05912D

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3. Studies in Homogeneous Gas Reactions. I

4. Unimolecular Dissociations and Free Radical Recombination Reactions

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