Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5384122 | Chemical Physics Letters | 2011 | 4 Pages |
Abstract
⺠Size-dependent electronic structure of rutile TiO2 quantum dots. ⺠The passivation results in increasing the HOMO-LUMO gap. ⺠The HOMO densities for rutile quantum dots are delocalized throughout the whole cluster. ⺠The LUMO densities are strongly localized on few surface Ti atoms.
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Authors
Suman Kalyan Sahoo, Sougata Pal, Pranab Sarkar, Chiranjib Majumder,