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Please use this identifier to cite or link to this item: https://hdl.handle.net/2440/119471
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dc.contributor.advisorSumby, Christopher J.-
dc.contributor.authorEvans, Jack D.-
dc.date.issued2015-
dc.identifier.urihttp://hdl.handle.net/2440/119471-
dc.description.abstractPorous materials play vital roles in many industries and currently there is intense interest in developing new examples due to their direct application to clean energy technologies. Many materials, currently the principal focus of research in this area, are constructed by strong covalent or coordination bonds extending in three-dimensions to produce a porous framework structure...en
dc.language.isoenen
dc.subjectMolecular simulationsen
dc.subjectPorous materialsen
dc.subjectMOFsen
dc.subjectDFTen
dc.titleSimulations of Molecular and Extended Porous Materialsen
dc.typeThesisen
dc.contributor.schoolSchool of Physical Sciencesen
dc.provenanceThis electronic version is made publicly available by the University of Adelaide in accordance with its open access policy for student theses. Copyright in this thesis remains with the author. This thesis may incorporate third party material which has been used by the author pursuant to Fair Dealing exceptions. If you are the owner of any included third party copyright material you wish to be removed from this electronic version, please complete the take down form located at: http://www.adelaide.edu.au/legalsen
dc.description.dissertationThesis (Ph.D.) -- University of Adelaide, School of Physical Sciences, 2015en
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