Permutationally Restrained Diabatization by Machine Intelligence-Reference-Cited by-同舟云学术

Permutationally Restrained Diabatization by Machine Intelligence

Published:2021-01-06 Issue:2 Volume:17 Page:1106-1116
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Shu Yinan^ORCID,Varga Zoltan^ORCID,Sampaio de Oliveira-Filho Antonio Gustavo¹^ORCID,Truhlar Donald G.^ORCID

Affiliation:

1. Departamento de Química, Laboratório Computacional de Espectroscopia e Cinética, Faculdade de Filosofia, Ciências e Letras de Ribeirão Preto, Universidade de São Paulo, 14040-901 Ribeirão Preto, São Paulo, Brazil

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.0c01110

Reference47 articles.

1. Energy transfer in collisions of an excited sodium atom with a nitrogen molecule

2. Trajectory Surface Hopping Approach to Nonadiabatic Molecular Collisions: The Reaction of H+ with D2

3. Surface-hopping trajectory calculations of collision-induced dissociation processes with and without charge transfer

4. The quenching of Na(3 2P) by H2: Interactions and dynamics

5. Trajectory‐surface‐hopping study of Na(3p 2P) +H2 → Na(3s 2S)+H2(v′, j′, θ)

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