First-principles study of structural and response properties of barium titanate phases.

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dc.contributor.authorEong Sheng, Goh
dc.date.accessioned2018-08-06T02:02:07Z
dc.date.available2018-08-06T02:02:07Z
dc.date.issued2017-03
dc.description.abstractSifat keadaan asas BaTiO3 perovskite kristal dalam kedua-dua bentuk pukal dan kepingan telah dikaji dengan menggunakan prinsip pertama Teori Fungsian Ketumpatan (DFT) dan kaedah projektor gelombang imbuhan. Ground state properties of BaTiO3 perovskite crystal, both in bulk and slab form, were studied using first-principles density functional theory (DFT) using the projectoraugmented wave methods.en_US
dc.identifier.urihttp://hdl.handle.net/123456789/6189
dc.language.isoenen_US
dc.publisherUniversiti Sains Malaysiaen_US
dc.subjectPrinciplesen_US
dc.subjectPropertiesen_US
dc.titleFirst-principles study of structural and response properties of barium titanate phases.en_US
dc.typeThesisen_US
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