Density functional theory investigations of bismuth vanadate: Effect of hybrid functionals

Computational Materials Science - Tập 74 - Trang 33-39 - 2013
Nitin Wadnerkar1, Niall J. English1,2
1The SFI Strategic Research Cluster in Solar Energy Conversion, School of Chemical and Bioprocess Engineering, Belfield, Dublin 4, Ireland
2Centre for Synthesis and Chemical Biology, University College Dublin, Belfield, Dublin 4, Ireland

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