General Approach to Compute Vibrationally Resolved One-Photon Electronic Spectra-Reference-Cited by-同舟云学术

General Approach to Compute Vibrationally Resolved One-Photon Electronic Spectra

Published:2010-03-12 Issue:4 Volume:6 Page:1256-1274
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Bloino Julien¹,Biczysko Malgorzata¹,Santoro Fabrizio¹,Barone Vincenzo¹

Affiliation:

1. Scuola Normale Superiore, piazza dei Cavalieri 7, 56126 Pisa, Italy, Dipartimento di Chimica “Paolo Corradini” and CR-INSTM Village Università di Napoli Federico II, Complesso Universitario Monte S. Angelo, via Cintia, 80126 Napoli, Italy, and Istituto per i Processi Chimico Fisici, Area della Ricerca-CNR, via G. Moruzzi 1, 56124 Pisa, Italy

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct9006772

Reference74 articles.

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

2. Effective method for the computation of optical spectra of large molecules at finite temperature including the Duschinsky and Herzberg–Teller effect: The Qx band of porphyrin as a case study

3. Vibronically-induced change in the chiral response of molecules revealed by electronic circular dichroism spectroscopy

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