An Efficient Analytic Approach for Calculation of Multi-Dimensional Franck–Condon Factors and Associated Photoelectron Spectra-Reference-Cited by-同舟云学术

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An Efficient Analytic Approach for Calculation of Multi-Dimensional Franck–Condon Factors and Associated Photoelectron Spectra

Published:2017-04-12 Issue:5 Volume:13 Page:2147-2158
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Sattasathuchana Tosaporn¹,Murri Riccardo²,Baldridge Kim K.¹³^ORCID

Affiliation:

1. Department of Chemistry, University of Zurich, Winterthurerstrasse 190, CH-8057 Zurich, Switzerland

2. Service and Support for Science IT, University of Zurich, Winterthurerstrasse 190, CH-8057 Zurich, Switzerland

3. Health Science Platform, Tianjin University, 92 Weijin Road, Nankai District, Tianjin, 300072, China

Funder

Schweizerischer Nationalfonds zur Förderung der Wissenschaftlichen Forschung

Ministry of Science and Technology of the People's Republic of China

Qian Ren Scholar Program of China

Synergetic Innovation Center of Chemical Science and Engineering, Tianjin University

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.7b00142

Reference51 articles.

1. A new method to calculate Franck–Condon factors of multidimensional harmonic oscillators including the Duschinsky effect

2. A general analytical expression for the two-dimensional Franck–Condon integral and simulation of the photoelectron spectra of nitrogen dioxide

3. A combined ab initio and Franck–Condon simulation study of the photodetachment spectrum of the anion

4. An analytical approach for computing Franck-Condon integrals of harmonic oscillators with arbitrary dimensions

5. Fully Integrated Approach to Compute Vibrationally Resolved Optical Spectra: From Small Molecules to Macrosystems

Cited by 10 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Reassignment of the Photoelectron Spectrum of Methylketene Using a Hybrid Model of Harmonic and Anharmonic Oscillators to Compute Franck–Condon Factors;ACS Omega;2023-10-17

2. Franck‐Condon factors within damped displacement harmonic oscillators: Solvent‐enhanced absorption and fluorescence spectra;Journal of the Chinese Chemical Society;2022-11-15

3. Correction to “An Efficient Analytic Approach for Calculation of Multi-Dimensional Franck–Condon Factors and Associated Photoelectron Spectra”;Journal of Chemical Theory and Computation;2020-06-30

4. Generalized Analytic Approach for Determination of Multidimensional Franck–Condon Factors: Simulated Photoelectron Spectra of Polynuclear Aromatic Hydrocarbons;Journal of Chemical Theory and Computation;2020-06-26

5. Branching Ratios, Radiative Lifetimes, and Transition Dipole Moments for YbOH;The Journal of Physical Chemistry A;2020-03-31

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