Following the density evolution using real time density functional theory and density based indexes: Application to model push

Following the density evolution using real time density functional theory and density based indexes: Application to model push–pull molecules

Published:2022-06-29 Issue:22 Volume:43 Page:1464-1473
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J Comput Chem

Author:

Korsaye Feven Alemu¹²,de la Lande Aurélien²^ORCID,Ciofini Ilaria¹^ORCID

Affiliation:

1. PSL University, CNRS, Chimie ParisTech‐PSL, Institute of Chemistry for Life and Health Sciences (i‐CLeHS) Theoretical Chemistry and Modelling Group (CTM) Paris France

2. Institut de Chimie Physique Université Paris Saclay, CNRS, UMR 8000 Orsay France

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/jcc.26932

Reference65 articles.

1. Density-Functional Theory for Time-Dependent Systems

2. Time-Dependent Density Functional Response Theory for Molecules

3. The calculations of excited-state properties with Time-Dependent Density Functional Theory

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