Temperature‐dependent approach to chemical reactivity concepts in density functional theory-Reference-Cited by-同舟云学术

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Temperature‐dependent approach to chemical reactivity concepts in density functional theory

Published:2018-10-11 Issue:2 Volume:119 Page:e25797
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int J Quantum Chem

Author:

Gázquez José L.¹^ORCID,Franco‐Pérez Marco²,Ayers Paul W.³,Vela Alberto⁴

Affiliation:

1. Departamento de QuímicaUniversidad Autónoma Metropolitana‐Iztapalapa Ciudad de México Mexico

2. Facultad de QuímicaUniversidad Nacional Autónoma de México, Cd. Universitaria Ciudad de México Mexico

3. Department of ChemistryMcMaster University Hamilton Ontario

4. Departamento de QuímicaCentro de Investigación y de Estudios Avanzados Ciudad de México Mexico

Funder

Natural Sciences and Engineering Research Council of Canada

Universidad Autónoma Metropolitana

Compute Canada

Canada Research Chairs

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/qua.25797

Reference154 articles.

1. Electronegativity: The density functional viewpoint

2. Bounds on scattering amplitudes

3. Electronegativity

4. THE NATURE OF THE CHEMICAL BOND. IV. THE ENERGY OF SINGLE BONDS AND THE RELATIVE ELECTRONEGATIVITY OF ATOMS

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