Maximum bonding fragment orbitals for deciphering complex chemical interactions
Author:
Affiliation:
1. Departamento de Química, Módulo 13
2. Universidad Autónoma de Madrid
3. 28049 Madrid
4. Spain
5. Institute for Advanced Research in Chemical Sciences (IAdChem)
Abstract
An optimal set of fragment orbitals is proposed as a simple and powerful tool for analyzing complex bonding interactions.
Funder
European Cooperation in Science and Technology
Secretaría de Estado de Investigación, Desarrollo 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/2018/CP/C8CP01808A
Reference145 articles.
1. Building Bridges Between Inorganic and Organic Chemistry(Nobel Lecture)
2. The Isolobal Analogy“”
3. Structural chemistry of donor-acceptor interactions
4. Donor–acceptor chemistry in the main group
5. F. Weinhold and C. R.Landis , Valency and Bonding: A Natural Bond Orbital Donor–Acceptor Perspective , Cambridge University Press , Cambridge , 2005
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