相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。Study on the shape control and photocatalytic activity of high-energy anatase titania
Zhouyou Wang et al.
APPLIED CATALYSIS B-ENVIRONMENTAL (2010)
Pivotal role of fluorine in enhanced photocatalytic activity of anatase TiO2 nanosheets with dominant (001) facets for the photocatalytic degradation of acetone in air
Quanjun Xiang et al.
APPLIED CATALYSIS B-ENVIRONMENTAL (2010)
Transition levels of defect centers in ZnO by hybrid functionals and localized basis set approach
Federico Gallino et al.
JOURNAL OF CHEMICAL PHYSICS (2010)
Intrinsic n-type Defect Formation in TiO2: A Comparison of Rutile and Anatase from GGA plus U Calculations
Benjamin J. Morgan et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2010)
Trap states and carrier dynamics of TiO2 studied by photoluminescence spectroscopy under weak excitation condition
Xiuli Wang et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2010)
Density-functional characterization of antiferromagnetism in oxygen-deficient anatase and rutile TiO2
Kesong Yang et al.
PHYSICAL REVIEW B (2010)
Hybrid functional studies of the oxygen vacancy in TiO2
A. Janotti et al.
PHYSICAL REVIEW B (2010)
Oxygen Vacancy Origin of the Surface Band-Gap State of TiO2(110)
C. M. Yim et al.
PHYSICAL REVIEW LETTERS (2010)
Energetics and diffusion of intrinsic surface and subsurface defects on anatase TiO2(101)
Hongzhi Cheng et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
A Density Functional Theory plus U Study of Oxygen Vacancy Formation at the (110), (100), (101), and (001) Surfaces of Rutile TiO2
Benjamin J. Morgan et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2009)
Nature of Ti Interstitials in Reduced Bulk Anatase and Rutile TiO2
Emanuele Finazzi et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2009)
Reduced and n-Type Doped TiO2: Nature of Ti3+ Species
Cristiana Di Valentin et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2009)
Exploring the Spatial Distribution and Transport Behavior of Charge Carriers in a Single Titania Nanowire
Takashi Tachikawa et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2009)
Screened hybrid density functionals for solid-state chemistry and physics
Benjamin G. Janesko et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2009)
Polaronic trapping of electrons and holes by native defects in anatase TiO2
Benjamin J. Morgan et al.
PHYSICAL REVIEW B (2009)
Excess electron states in reduced bulk anatase TiO2: Comparison of standard GGA, GGA plus U, and hybrid DFT calculations
Emanuele Finazzi et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
Anatase TiO2 single crystals with a large percentage of reactive facets
Hua Gui Yang et al.
NATURE (2008)
Defect energetics in ZnO: A hybrid Hartree-Fock density functional study
Fumiyasu Oba et al.
PHYSICAL REVIEW B (2008)
Ab initio study of the electronic states induced by oxygen vacancies in rutile and anatase TiO2
G. Mattioli et al.
PHYSICAL REVIEW B (2008)
Atomic control of conductivity versus ferromagnetism in wide-gap oxides via selective doping:: V, Nb, Ta in anatase TiO2
Jorge Osorio-Guillen et al.
PHYSICAL REVIEW LETTERS (2008)
TiO2 photocatalysis and related surface phenomena
Akira Fujishima et al.
SURFACE SCIENCE REPORTS (2008)
Oxygen vacancies in transition metal and rare earth oxides: Current state of understanding and remaining challenges
M. Veronica Ganduglia-Pirovano et al.
SURFACE SCIENCE REPORTS (2007)
Photoluminescence characteristics of TiO2 and their relationship to the photoassisted reaction of water/methanol mixture
Jianying Shi et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2007)
Comparison of the electronic structure of anatase and rutile TiO2 single-crystal surfaces using resonant photoemission and x-ray absorption spectroscopy
A. G. Thomas et al.
PHYSICAL REVIEW B (2007)
Influence of the exchange screening parameter on the performance of screened hybrid functionals
Aliaksandr V. Krukau et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Mott transition of MnO under pressure: A comparison of correlated band theories
Deepa Kasinathan et al.
PHYSICAL REVIEW B (2006)
Low temperature kinetics and energetics of the electron and hole traps in irradiated TiO2 nanoparticles as revealed by EPR spectroscopy
Shyue-Chu Ke et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2006)
Hybrid functionals based on a screened Coulomb potential (vol 118, pg 8207, 2003)
Jochen Heyd et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
EPR investigation of TiO2 nanoparticles with temperature-dependent properties
CP Kumar et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2006)
First-principles study of native defects in anatase TiO2
S Na-Phattalung et al.
PHYSICAL REVIEW B (2006)
Photoelectron spectroscopy of nanocrystalline anatase TiO2 films
A Orendorz et al.
APPLIED SURFACE SCIENCE (2005)
Light-induced charge separation in anatase TiO2 particles
T Berger et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
First-principles calculations for defects and impurities: Applications to III-nitrides
CG Van de Walle et al.
JOURNAL OF APPLIED PHYSICS (2004)
Identification of reactive species in photoexcited nanocrystalline TiO2 films by wide-wavelength-range (400-2500 nm) transient absorption spectroscopy
T Yoshihara et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2004)
Structure and reactivity of V2O5: bulk solid, nanosized clusters, species supported on silica and alumina, cluster cations and anions
J Sauer et al.
DALTON TRANSACTIONS (2004)
Hybrid functionals based on a screened Coulomb potential
J Heyd et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Insights into photoexcited electron scavenging processes on TiO2 obtained from studies of the reaction of O2 with OH groups adsorbed at electronic defects on TiO2(110)
MA Henderson et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2003)
Modeling charge self-trapping in wide-gap dielectrics: Localization problem in local density functionals
JL Gavartin et al.
PHYSICAL REVIEW B (2003)
Photo-induced surface charge separation of highly oriented TiO2 anatase and rutile thin films
T Sumita et al.
APPLIED SURFACE SCIENCE (2002)
Composition, structure, and stability of RuO2(110) as a function of oxygen pressure -: art. no. 035406
K Reuter et al.
PHYSICAL REVIEW B (2002)
Crystal faces of rutile and anatase TiO2 particles and their roles in photocatalytic reactions
T Ohno et al.
NEW JOURNAL OF CHEMISTRY (2002)
Structure and energetics of stoichiometric TiO2 anatase surfaces -: art. no. 155409
M Lazzeri et al.
PHYSICAL REVIEW B (2001)
Theoretical description of hole localization in a quartz Al center: The importance of exact electron exchange
G Pacchioni et al.
PHYSICAL REVIEW B (2001)
Lewis acid and base sites at the surface of microcrystalline TiO2 anatase:: relationships between surface morphology and chemical behaviour
G Martra
APPLIED CATALYSIS A-GENERAL (2000)