Electronic and magnetic properties of V-doped anatase TiO2 from first principles

Electronic and magnetic properties of V-doped anatase TiO2 from first principles

We report a first-principles study on the geometric, electronic, and magnetic properties of V-doped anatase TiO2. The DFT+U (Hubbard coefficient) approach predicts semiconductor band structures for Ti1−xVxO2 (x=6.25% and 12.5%), in good agreement with the poor conductivity of samples,...

Saved in:

書目詳細資料
Main Authors:	Du, Xiaosong, Li, Qunxiang, Su, Haibin, Yang, Jinlong
其他作者:	School of Materials Science & Engineering
格式:	Article
語言:	English
出版:	2011
主題:	DRNTU::Engineering::Materials::Magnetic materials
在線閱讀:	https://hdl.handle.net/10356/92048 http://hdl.handle.net/10220/6924
標簽:	添加標簽沒有標簽, 成為第一個標記此記錄!

相似書籍

Theoretical study on the magnetic moments formation in Ta-doped anatase TiO2
由: Bupu, A.X, et al.
出版: (2020)

Strain effect on electronic structures of graphene nanoribbons : a first-principles study
由: Shi, Q. W., et al.
出版: (2011)

Valence-electron distribution in MgB2 by accurate diffraction measurements and first-principles calculations
由: Wu, Lijun, et al.
出版: (2011)

First-principles study of the magnetism in indium oxide-based dilute magnetic semiconductors
由: Guan, Lixiu
出版: (2011)

Pair-hopping characteristic of lithium diffusive motion in Li-doped β-phase manganese phthalocyanine
由: Du, Xiaosong, et al.
出版: (2011)

The origin of visible light absorption in chalcogen element (S, Se, and Te)-doped anatase TiO2 photocatalysts
由: Dong, Zhili, et al.
出版: (2011)

Growth and magnetic properties of TiO2: Co anatase thin films by sputtering technique
由: Han, G.C., et al.
出版: (2014)

Ultrathin anatase TiO2 nanosheets embedded with TiO2-B nanodomains for lithium-ion storage : capacity enhancement by phase boundaries
由: Wu, Qili, et al.
出版: (2015)

Magnetic nanobelts of iron-doped zinc oxide
由: Yu, M. B., et al.
出版: (2011)

Magnetic nanobraids of iron-doped amorphous silica
由: Yu, M. B., et al.
出版: (2011)

FIRST-PRINCIPLES CALCULATIONS OF 2D MAGNETIC MATERIALS AND THEIR HETEROSTRUCTURES
由: XU RUNRUN
出版: (2020)

Dynamical mean-field theoretical approach to explore the temperature-dependent magnetization in Ta-doped TiO2
由: Majidi, M.A, et al.
出版: (2020)

Electronic mechanism of critical temperature variation in RBa2Cu3O7−δ
由: Chen, Xiao Jia, et al.
出版: (2011)

Control of Photoactivity over Polycrystalline Anatase TiO 2 Thin Films via Surface Potential
由: Ong, S. W. Daniel, et al.
出版: (2016)

Magnetic and magnetotransport properties in copper and iron co-doped bulk indium oxide and indium tin oxide.
由: Ho, Hui Wen.
出版: (2009)

Reactive ion etching of NiFe thin films from first-principles study: A case study
由: Watanabe, Susumu, et al.
出版: (2005)

First-principles study of effects of combined ti supervalent cations and lithium ion vacancies doping on crystal and electronic structures and conductivity in lifepo<inf>4</inf>
由: Chanaprom Cholsuk, et al.
出版: (2020)

Synthesis of Nitrogen doped TiO2 with superior ultrafast charging properties
由: Tang, Ernest Jun Jie
出版: (2019)

Effect of 100MeV Ag+7 ion irradiation on the bulk and surface magnetic properties of Co-Fe-Si thin films
由: Hysen, T., et al.
出版: (2014)

A facile synthesis of nanocrystalline anatase TiO<inf>2</inf>from TiOSO<inf>4</inf>aqueous solution
由: Songpon Ngamta, et al.
出版: (2018)

Measuring the hole-state anisotropy in MgB2 by electron energy-loss spectroscopy
由: Klie, Robert F., et al.
出版: (2011)

Magnetic materials of rare-earth permanent magnets
由: Aw, Charlotte Bixi
出版: (2010)

Soft magnetic materials for aerospace applications
由: Loganathan, Swarup Kumar
出版: (2021)

Effects of energetics with {001} facet-dominant anatase TiO2 scaffold on electron transport in CH3NH3PbI3 perovskite solar cells
由: Maitani, Masato M., et al.
出版: (2020)

Synthesis of two-dimensional materials for potential magnetic properties
由: Chau, Melissa Weng Yee
出版: (2021)

Nanostructured magnetic materials
由: Mohammad Mujahid.
出版: (2008)

Oxidation mechanism of rare-earth SmCo permanent magnet
由: Soh, Yan Da
出版: (2020)

Magnetism of two-dimensional chromium tellurides
由: Yang, Jiefu, et al.
出版: (2023)

Magnet-polymer composite transducers
由: Nguyen, Quang Vinh
出版: (2011)

Multifunctional magnet-polymer transducers
由: Ahmed, Anansa Sasha Shakil
出版: (2016)

Effect of external magnetic field on the preparation of nitrogen-doped diamond-like carbon films
由: Du, Wenhan, et al.
出版: (2023)

First-principle investigations of nanoscale carbon-based materials for their electronic properties and potential applications
由: Wang, Min
出版: (2011)

Non-equilibrium processing of magnetic nanocomposites
由: Shukla, Shashwat.
出版: (2013)

Disorder and coercivity in magnetic particle systems
由: Zhao, Yang, et al.
出版: (2011)

Structural and electrical properties of Nb-doped anatase TiO2 nanowires by electrospinning
由: Archana, P.S., et al.
出版: (2014)

Anatase TiO<inf>2</inf> (101) and wurtzite ZnO (001) modified polymer for visible light-photocatalytic efficiency enhancement
由: Thanawat Kantawong, et al.
出版: (2018)

Influence of calcination temperature on anatase to rutile phase transformation in TiO<inf>2</inf>nanoparticles synthesized by the modified sol-gel method
由: Natda Wetchakun, et al.
出版: (2018)

Evidence for electronic signature of a magnetic transition in the topological magnet HoSbTe
由: Shumiya, Nana, et al.
出版: (2022)

First-principle study of local and electronic structures of yttrium-doped Ba (Zr <inf>x</inf>Ti <inf>1</inf><inf>-</inf><inf>x</inf>) O <inf>3</inf>
由: W. Thammada, et al.
出版: (2019)

Nanostructured soft magnetic materials by ball milling
由: Sritharan, Thirumany.
出版: (2008)