Unravelling the solvent polarity effect on the excited state intramolecular proton transfer mechanism of the 1- and 2-salicylideneanthrylamine. A TD-DFT case study-Reference-Cited by-同舟云学术

Unravelling the solvent polarity effect on the excited state intramolecular proton transfer mechanism of the 1- and 2-salicylideneanthrylamine. A TD-DFT case study

Published:2019 Issue:2 Volume:21 Page:915-928
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Muriel Wilver A.¹²³⁴⁵^ORCID,Morales-Cueto Rodrigo⁶⁷⁸⁹¹⁰^ORCID,Rodríguez-Córdoba William¹²³⁴⁵^ORCID

Affiliation:

1. Universidad Nacional de Colombia – Sede Medellín

2. Facultad de Ciencias

3. Escuela de Física

4. Laboratorio de Fotónica y Optoelectrónica

5. Medellín

6. Centro de Investigaciones Químicas

7. Instituto de Investigación en Ciencias Básicas y Aplicadas

8. Universidad Autónoma del Estado de Morelos

9. 62209 Cuernavaca Morelos

10. Mexico

Abstract

TD-DFT has been used to investigate the relaxation pathways of 1- and 2-salicylideneanthrylamine in different solvent environments.

Funder

Departamento Administrativo de Ciencia, Tecnología e Innovación

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2019/CP/C8CP06298F

Reference69 articles.

1. Three-Dimensional Optical Data Storage Using Photochromic Materials

2. Photodynamics of Schiff Base Salicylideneaniline: Trajectory Surface-Hopping Simulations

3. Electronic-structure and quantum dynamical study of the photochromism of the aromatic Schiff base salicylideneaniline

4. Initial Processes of Proton Transfer in Salicylideneaniline Studied by Time-Resolved Photoelectron Spectroscopy

5. Photochromism of salicylideneaniline (SA). How the photochromic transient is created: A theoretical approach

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