Computational Studies & Assisted Structural Characterisation of Metal-Organic Frameworks

Loader, Jason R (2013) Computational Studies & Assisted Structural Characterisation of Metal-Organic Frameworks. PhD thesis, University of Sheffield.

Metadata

Supervisors: Lee, Brammer and Anthony J H M, Meijer
Keywords: Metal-Organic Frameworks, MOFs, Intermolecular Interactions, Hydrogen Bonds, Bifuracted, Supramolecular Chemistry, Self-Assembly, Coordination Polymers, Computational Chemistry, Molecular Modelling, Characterisation, Post-Synthetic Modification, Density Functional Theory, X-Ray Diffraction, GOLD, CCDC, Paddlewheel
Awarding institution: University of Sheffield
Academic Units: The University of Sheffield > Faculty of Science (Sheffield) > Chemistry (Sheffield)
Depositing User: Mr Jason R Loader
Date Deposited: 30 Jan 2014 15:32
Last Modified: 31 Jan 2014 09:50
Open Archives Initiative ID (OAI ID):

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Filename: Part0-Cover&AdminPages.pdf

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Chapter One


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Filename: Part1-MOFIntro-FINAL.pdf

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Chapter Two


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Filename: Part2-ComputationalIntro-FINAL.pdf

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Chapter Three


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Filename: Part3-CamphorateResults-FINAL.pdf

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Chapter Four


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Filename: Part4-CamphorateResults2-FINAL.pdf

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Chapter Five


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Filename: Part5-AzolatesCarboxylates-FINAL.pdf

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Chapter Six


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Filename: Part6-CSDHydrogenBonds-FINAL.pdf

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Appendix


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Filename: Part7-Appendix.pdf

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