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dc.contributor.authorZhao, Wen
dc.contributor.supervisorProf. Julian Galeen_US
dc.date.accessioned2017-08-03T07:50:34Z
dc.date.available2017-08-03T07:50:34Z
dc.date.issued2017
dc.identifier.urihttp://hdl.handle.net/20.500.11937/54058
dc.description.abstract

This study investigated the nucleation and growth mechanisms of calcium oxalate in aqueous solution through the use of atomistic computer simulation based on both force fields and density functional theory. As a result, this research has shed light on the initial speciation and cluster formation of calcium oxalate in water, as well as on the structures and stability of the solid anhydrous phase.

en_US
dc.titleUnderstanding the nucleation and growth mechanisms of calcium oxalate in aqueous solution by computer simulationen_US
dc.typeThesisen_US
dcterms.educationLevelPhDen_US
curtin.departmentChemistryen_US
curtin.accessStatusOpen accessen_US
curtin.facultyScience and Engineeringen_US


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