About: Hybrid functional studies of the oxygen vacancy inTiO2

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scholarly article in Physical Review B, vol. 81 no. 8, February 2010

Attributes	Values
rdf:type	Item
description	wetenschappelijk artikel (nl) article scientifique publié en 2010 (fr) наукова стаття, опублікована в лютому 2010 (uk) im Februar 2010 veröffentlichter wissenschaftlicher Artikel (de) scholarly article in Physical Review B, vol. 81 no. 8, February 2010 (en)
publication date	wds:Q56423721-BC171C39-33E7-45C6-A63F-C22B40BE0FC4
publication date	2010-02-16 00:00:00Z (xsd:dateTime)
language of work or name	wds:Q56423721-FF6C3E57-9236-4284-90AF-3DF2E9DAF388
language of work or name	English
cites work	wds:Q56423721-0450AFEF-38D7-44C9-8C61-019F81D2E09A wds:Q56423721-17B819DE-D278-47F6-BD42-429A0768A3E8 wds:Q56423721-3A79B0E7-E3D6-4A1A-9270-77C31F863AFF wds:Q56423721-4003893A-9B94-4BD1-BAD8-33DE406EC3F0 wds:Q56423721-6B8F6ECB-6B22-44AF-B288-EBF6F84FBEEB wds:Q56423721-93C0ACE4-18A9-4FF5-96D3-B8851F496F33 wds:Q56423721-AA4F15F5-14B0-4572-BC19-F3D3A7FFBA0B wds:Q56423721-ACDC656A-A559-4CD4-A5FB-8965B3491105 wds:Q56423721-C30335D3-6310-4330-A7A4-5C26E4800E11 wds:Q56423721-C58A1C9A-D6E5-4EEC-B31D-367CE3A609DA wds:Q56423721-C7994810-0577-4A8F-B236-62695E2D77C9 wds:Q56423721-C940ECB9-2DEA-4B60-9E24-F6C1BCAC95A2 wds:Q56423721-C9AB11C3-A07B-405A-AB46-FA67BC746AD6 wds:Q56423721-E450DF44-3817-49EC-A7E1-ACC2A3FF17ED wds:Q56423721-F3D021B5-BCB0-4C68-BCEE-47D0C5E122C0 wds:Q56423721-F730E632-DEB4-4B12-9292-F591037DF89F
cites work	A low-cost, high-efficiency solar cell based on dye-sensitized colloidal TiO2 films Generalized Gradient Approximation Made Simple Projector augmented-wave method From ultrasoft pseudopotentials to the projector augmented-wave method Self-Consistent Equations Including Exchange and Correlation Effects Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set Electrochemical photolysis of water at a semiconductor electrode High-κ gate dielectrics: Current status and materials properties considerations Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set The surface science of titanium dioxide First-principles calculations for defects and impurities: Applications to III-nitrides Electrical properties and defect chemistry of TiO2 single crystal. I. Electrical conductivity. Excess electron states in reduced bulk anatase TiO2: Comparison of standard GGA, GGA+U, and hybrid DFT calculations Optimizing optical absorption of TiO2 by alloying with TiS2 Oxygen vacancies in ZnO Diffusion mechanisms of native point defects in rutileTiO2:Ab initiototal-energy calculations
author name string	wds:Q56423721-51281382-116F-4DEE-A3FA-2CE859B198CC wds:Q56423721-6E107650-28DC-4E6D-903C-EA2A714F8DBA wds:Q56423721-847F6AA0-B9BC-496D-80F8-67D6EC1D948F
author name string	N. Umezawa C. G. Van de Walle J. B. Varley
rdfs:label	Hybrid functional studies of the oxygen vacancy inTiO2 (en) Hybrid functional studies of the oxygen vacancy inTiO2 (nl)
skos:prefLabel	Hybrid functional studies of the oxygen vacancy inTiO2 (en) Hybrid functional studies of the oxygen vacancy inTiO2 (nl)
name	Hybrid functional studies of the oxygen vacancy inTiO2 (en) Hybrid functional studies of the oxygen vacancy inTiO2 (nl)
author	wds:Q56423721-50849E39-DAC4-471D-8387-F5716474544E wds:Q56423721-705B2485-C108-414B-8105-4F790E908F57 wds:Q56423721-98DFF8F0-D381-48E4-B6E8-DFC7AF10AFCE
author	Georg Kresse Anderson Janotti Patrick Rinke
title	wds:Q56423721-D0A178B9-B861-4ECB-8D17-2C625C0DDC49
title	Hybrid functional studies of the oxygen vacancy inTiO2 (en)
instance of	wds:Q56423721-3FF31A81-7C3E-4AAF-BD67-B68ADF60D1BC
instance of	scholarly article
published in	wds:Q56423721-3F26773E-E43C-4278-B81A-9A176FD458BB
published in	Physical Review B
issue	wds:Q56423721-98C4D7F1-3CD0-4ADA-9B0B-292ADF8A9FB4
volume	wds:Q56423721-CB09E4BB-0414-4D24-B202-0D106200EC9E
issue	8
volume	81
DOI	wds:Q56423721-FAA502F5-7307-492A-ADCC-26FAF3AB8C4A
DOI	http://dx.doi.org/10.1103/PHYSREVB.81.085212
DOI	10.1103/PHYSREVB.81.085212
ResearchGate publication ID	wds:Q56423721-FBEF1B28-8C7F-424B-A0AC-002A4F581096
ResearchGate publication ID	235480331
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q56423721
is cites work of	Electronic excitations in light absorbers for photoelectrochemical energy conversion: first principles calculations based on many body perturbation theory. Reduced TiO2 nanotube arrays for photoelectrochemical water splitting Modelling heterogeneous interfaces for solar water splitting Dual behavior of excess electrons in rutile TiO2 Matildite versus schapbachite: First-principles investigation of the origin of photoactivity inAgBiS2 Limits to doping in oxides Color centers in NaCl by hybrid functionals Theoretical prediction of p-type transparent conductivity in Zn-doped TiO2. LDA + U and hybrid functional calculations for defects in ZnO, SnO2, and TiO2 Characterization of electroforming-free titanium dioxide memristors A hybrid density functional study on the electron and hole trap states in anatase titanium dioxide. Self-energy and excitonic effects in the electronic and optical properties ofTiO2crystalline phases Self-regulation of charged defect compensation and formation energy pinning in semiconductors Selective isolation of the electron or hole in photocatalysis: ZnO-TiO2 and TiO2-ZnO core-shell structured heterojunction nanofibers via electrospinning and atomic layer deposition. Tuning defects in oxides at room temperature by lithium reduction. Mechanism of photocatalytic activities in Cr-doped SrTiO3 under visible-light irradiation: an insight from hybrid density-functional calculations Gap states assisted MoO3 nanobelt photodetector with wide spectrum response Theoretical design of highly active SrTiO3-based photocatalysts by a codoping scheme towards solar energy utilization for hydrogen production Electronic structure and phase stability of oxide semiconductors: Performance of dielectric-dependent hybrid functional DFT, benchmarked againstGWband structure calculations and experiments Function ofTiO2Lattice Defects toward Photocatalytic Processes: View of Electronic Driven Force Charge storage in oxygen deficient phases of TiO2: defect Physics without defects Titanium Dioxide Engineered for Near-dispersionless High Terahertz Permittivity and Ultra-low-loss Decoupling free-carriers contributions from oxygen-vacancy and cation-substitution in extrinsic conducting oxides Electronic resistance switching in the Al/TiO(x)/Al structure for forming-free and area-scalable memory.

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