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Ab initio study of advanced functional materials

  • China Academy of Engineering Physics

Research output: Chapter in Book/Report/Conference proceedingConference contributionpeer-review

Abstract

Ab initio total energy calculations and molecular dynamics calculations have been used to examine the functional materials, such as TiO2 and graphene in order to advance our understanding and prediction of novel structures and properties.

Original languageEnglish
Title of host publicationNanophotonics, Nanoelectronics and Nanosensor, N3 2013
PublisherOptical Society of America (OSA)
PagesNSa4A.6
ISBN (Print)9781557529763
DOIs
StatePublished - 2013
Externally publishedYes
EventNanophotonics, Nanoelectronics and Nanosensor, N3 2013 - Wuhan, China
Duration: 25 May 201326 May 2013

Publication series

NameNanophotonics, Nanoelectronics and Nanosensor, N3 2013

Conference

ConferenceNanophotonics, Nanoelectronics and Nanosensor, N3 2013
Country/TerritoryChina
CityWuhan
Period25/05/1326/05/13

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