Computational modelling of inorganic solids

Moore, Elaine Ann (2012). Computational modelling of inorganic solids. Anual Reports on the Progress of Chemistry, Section A, Inorganic Chemistry, 108(1) pp. 449–463.

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DOI (Digital Object Identifier) Link:	http://dx.doi.org/10.1039/c2ic90015g

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Abstract

This report covers papers published in 2011 dealing with the application of computational techniques to inorganic solids. It deals mainly with continuous solids that are ionic in nature; work on metals and MOFs is excluded. Special attention is given to solids used in solid oxide fuel cells, iron-based superconductors, zeolites and systems of interest to the life and earth sciences. Relevant advances in computational methods are also covered.

Item Type:	Journal Article
Copyright Holders:	2012 The Royal Society of Chemistry
ISSN:	1460-4760
Academic Unit/Department:	Science > Life, Health and Chemical Sciences
Interdisciplinary Research Centre:	Centre for Earth, Planetary, Space and Astronomical Research (CEPSAR)
Item ID:	34068
Depositing User:	Elaine Moore
Date Deposited:	25 Jul 2012 14:00
Last Modified:	21 May 2013 07:54
URI:	http://oro.open.ac.uk/id/eprint/34068

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