Exploring potential energy surfaces using density functional theory and intrinsic reaction coordinate methods

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dc.contributor.advisorZeigler, Thomas
dc.contributor.authorDeng, Liqun
dc.date.accessioned2005-07-29T21:15:06Z
dc.date.available2005-07-29T21:15:06Z
dc.date.issued1996
dc.descriptionBibliography: p. 197-208.en
dc.format.extentxiv, 208 leaves ; 30 cm.en
dc.identifier.citationDeng, L. (1996). Exploring potential energy surfaces using density functional theory and intrinsic reaction coordinate methods (Doctoral thesis, University of Calgary, Calgary, Canada). Retrieved from https://prism.ucalgary.ca. doi:10.11575/PRISM/15178en_US
dc.identifier.doihttp://dx.doi.org/10.11575/PRISM/15178
dc.identifier.isbn0612127680en
dc.identifier.lccQD 461.5 D46 1996en
dc.identifier.urihttp://hdl.handle.net/1880/29002
dc.language.isoeng
dc.publisher.institutionUniversity of Calgaryen
dc.publisher.placeCalgaryen
dc.rightsUniversity of Calgary graduate students retain copyright ownership and moral rights for their thesis. You may use this material in any way that is permitted by the Copyright Act or through licensing that has been assigned to the document. For uses that are not allowable under copyright legislation or licensing, you are required to seek permission.
dc.subject.lccQD 461.5 D46 1996en
dc.subject.lcshExcited state chemistry
dc.subject.lcshMolecular dynamics
dc.titleExploring potential energy surfaces using density functional theory and intrinsic reaction coordinate methods
dc.typedoctoral thesis
thesis.degree.disciplineChemistry
thesis.degree.grantorUniversity of Calgary
thesis.degree.nameDoctor of Philosophy (PhD)
ucalgary.thesis.accessionTheses Collection 58.002:Box 1025 520538439
ucalgary.thesis.notesUARCen
ucalgary.thesis.uarcreleaseyen
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