Charge density analysis for crystal engineering

This review reports on the application of charge density analysis in the field of crystal engineering, which is one of the most growing and productive areas of the entire field of crystallography. While methods to calculate or measure electron density are not discussed in detail, the derived quantit...

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Detalles Bibliográficos
Autores principales: Krawczuk, Anna, Macchi, Piero
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2014
Materias:
Review
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4266768/
https://www.ncbi.nlm.nih.gov/pubmed/25520749
http://dx.doi.org/10.1186/s13065-014-0068-x
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author Krawczuk, Anna
Macchi, Piero
author_facet Krawczuk, Anna
Macchi, Piero
author_sort Krawczuk, Anna
collection PubMed
description This review reports on the application of charge density analysis in the field of crystal engineering, which is one of the most growing and productive areas of the entire field of crystallography. While methods to calculate or measure electron density are not discussed in detail, the derived quantities and tools, useful for crystal engineering analyses, are presented and their applications in the recent literature are illustrated. Potential developments and future perspectives are also highlighted and critically discussed. ELECTRONIC SUPPLEMENTARY MATERIAL: The online version of this article (doi:10.1186/s13065-014-0068-x) contains supplementary material, which is available to authorized users.
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spelling pubmed-42667682014-12-17 Charge density analysis for crystal engineering Krawczuk, Anna Macchi, Piero Chem Cent J Review This review reports on the application of charge density analysis in the field of crystal engineering, which is one of the most growing and productive areas of the entire field of crystallography. While methods to calculate or measure electron density are not discussed in detail, the derived quantities and tools, useful for crystal engineering analyses, are presented and their applications in the recent literature are illustrated. Potential developments and future perspectives are also highlighted and critically discussed. ELECTRONIC SUPPLEMENTARY MATERIAL: The online version of this article (doi:10.1186/s13065-014-0068-x) contains supplementary material, which is available to authorized users. Springer International Publishing 2014-12-16 /pmc/articles/PMC4266768/ /pubmed/25520749 http://dx.doi.org/10.1186/s13065-014-0068-x Text en © Krawczuk and Macchi; licensee Chemistry Central Ltd. 2014 This article is published under license to BioMed Central Ltd. This is an Open Access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/4.0), which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly credited. The Creative Commons Public Domain Dedication waiver (http://creativecommons.org/publicdomain/zero/1.0/) applies to the data made available in this article, unless otherwise stated.
spellingShingle Review
Krawczuk, Anna
Macchi, Piero
Charge density analysis for crystal engineering
title Charge density analysis for crystal engineering
title_full Charge density analysis for crystal engineering
title_fullStr Charge density analysis for crystal engineering
title_full_unstemmed Charge density analysis for crystal engineering
title_short Charge density analysis for crystal engineering
title_sort charge density analysis for crystal engineering
topic Review
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4266768/
https://www.ncbi.nlm.nih.gov/pubmed/25520749
http://dx.doi.org/10.1186/s13065-014-0068-x
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