4.6 Article

Charge Carriers Cascade in a Ternary TiO2/TiO2/ZnS Heterojunction: A DFT Study

Related references

Note: Only part of the references are listed.
Article Chemistry, Physical

Role of Heterojunction in Charge Carrier Separation in Coexposed Anatase (001)-(101) Surfaces

Giovanni Di Liberto et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2019)

Article Physics, Condensed Matter

Theoretical treatment of semiconductor heterojunctions for photocatalysis: the WO3/BiVO4 interface

Giovanni Di Liberto et al.

JOURNAL OF PHYSICS-CONDENSED MATTER (2019)

Review Physics, Condensed Matter

Introducing catalysis in photocatalysis: What can be understood from surface science studies of alcohol photoreforming on TiO2

Constantin A. Walenta et al.

JOURNAL OF PHYSICS-CONDENSED MATTER (2019)

Article Chemistry, Physical

Nitrogen doping in coexposed (001)-(101) anatase TiO2 surfaces: a DFT study

Giovanni Di Liberto et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2019)

Article Materials Science, Multidisciplinary

Accurate and efficient band-offset calculations from density functional theory

L. Weston et al.

COMPUTATIONAL MATERIALS SCIENCE (2018)

Article Chemistry, Multidisciplinary

Photoinduced Charge-Tran sfer Dynamics in WO3/BiVO4 Photoanodes Probed through Midinfrared Transient Absorption Spectroscopy

Ivan Grigioni et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2018)

Article Chemistry, Physical

The Work Function of TiO2

Shun Kashiwaya et al.

SURFACES (2018)

Article Chemistry, Physical

Origin of Visible Light Photoactivity of the CeO2/ZnO Heterojunction

Erik Cerrato et al.

ACS APPLIED ENERGY MATERIALS (2018)

Article Chemistry, Physical

Atomistic Explanation for Interlayer Charge Transfer in Metal-Semiconductor Nanocomposites: The Case of Silver and Anatase

Giovanni Di Liberto et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2017)

Article Chemistry, Physical

Size-Dependent Level Alignment between Rutile and Anatase TiO2 Nanoparticles: Implications for Photocatalysis

Kyoung Chul Ko et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2017)

Article Chemistry, Physical

Directly Probing Charge Separation at Interface of TiO2 Phase Junction

Yuying Gao et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2017)

Article Chemistry, Physical

Wavelength-Dependent Ultrafast Charge Carrier Separation in the WO3/BiVO4 Coupled System

Ivan Grigioni et al.

ACS ENERGY LETTERS (2017)

Review Chemistry, Multidisciplinary

Heterojunction Photocatalysts

Jingxiang Low et al.

ADVANCED MATERIALS (2017)

Article Chemistry, Multidisciplinary

TiO2-ZnS Cascade Electron Transport Layer for Efficient Formamidinium Tin Iodide Perovskite Solar Cells

Weijun Ke et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2016)

Article Materials Science, Multidisciplinary

Accurate ionization potential of semiconductors from efficient density functional calculations

Lin-Hui Ye

PHYSICAL REVIEW B (2016)

Review Chemistry, Multidisciplinary

Visible-light driven heterojunction photocatalysts for water splitting - a critical review

Savio J. A. Moniz et al.

ENERGY & ENVIRONMENTAL SCIENCE (2015)

Article Chemistry, Physical

Prediction Uncertainty of Density Functional Approximations for Properties of Crystals with Cubic Symmetry

Pascal Pernot et al.

JOURNAL OF PHYSICAL CHEMISTRY A (2015)

Article Chemistry, Physical

Dynamics of Photogenerated Charge Carriers in WO3/BiVO4 Heterojunction Photoanodes

Ivan Grigioni et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2015)

Article Chemistry, Physical

Resolving the Controversy about the Band Alignment between Rutile and Anatase: The Role of OH-/H+ Adsorption

Jolla Kullgren et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2015)

Article Energy & Fuels

Effect of Post-Synthesis Treatments on the Properties of ZnS Nanoparticles: An Experimental and Computational Study

Elena Balantseva et al.

OIL & GAS SCIENCE AND TECHNOLOGY-REVUE D IFP ENERGIES NOUVELLES (2015)

Review Chemistry, Multidisciplinary

Spectroscopic Properties of Doped and Defective Semiconducting Oxides from Hybrid Density Functional Calculations

Cristiana Di Valentin et al.

ACCOUNTS OF CHEMICAL RESEARCH (2014)

Article Nanoscience & Nanotechnology

Origin of High Photocatalytic Properties in the Mixed-Phase TiO2: A First-Principles Theoretical Study

Ming-Gang Ju et al.

ACS APPLIED MATERIALS & INTERFACES (2014)

Review Chemistry, Multidisciplinary

Theoretical Studies on Anatase and Less Common TiO2 Phases: Bulk, Surfaces, and Nanomaterials

Filippo De Angelis et al.

CHEMICAL REVIEWS (2014)

Review Chemistry, Multidisciplinary

Semiconductor heterojunction photocatalysts: design, construction, and photocatalytic performances

Huanli Wang et al.

CHEMICAL SOCIETY REVIEWS (2014)

Article Chemistry, Physical

CRYSTAL14: A Program for the Ab Initio Investigation of Crystalline Solids

Roberto Dovesi et al.

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2014)

Article Chemistry, Physical

CO2 Capture by TiO2 Anatase Surfaces: A Combined DFT and FTIR Study

Lorenzo Mino et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2014)

Article Chemistry, Physical

Unraveling the Cooperative Mechanism of Visible-Light Absorption in Bulk N,Nb Codoped TiO2 Powders of Nanomaterials

Chiara Marchiori et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2014)

Article Chemistry, Physical

Surface Properties of ZnS Nanoparticles: A Combined DFT and Experimental Study

Elena Balantseva et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2014)

Article Chemistry, Multidisciplinary

Enhanced Photocatalytic CO2-Reduction Activity of Anatase TiO2 by Coexposed {001} and {101} Facets

Jiaguo Yu et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2014)

Article Materials Science, Multidisciplinary

Self-consistent hybrid functional for condensed systems

Jonathan H. Skone et al.

PHYSICAL REVIEW B (2014)

Review Chemistry, Physical

Zinc Oxide-From Synthesis to Application: A Review

Agnieszka Kolodziejczak-Radzimska et al.

MATERIALS (2014)

Article Chemistry, Physical

Band alignment of rutile and anatase TiO2

David O. Scanlon et al.

NATURE MATERIALS (2013)

Article Physics, Applied

First principles calculations of the band offset at SrTiO3-TiO2 interfaces

Nunzio Roberto D'Amico et al.

APPLIED PHYSICS LETTERS (2012)

Article Chemistry, Physical

Electronic Structure of F-Doped Bulk Rutile, Anatase, and Brookite Polymorphs of TiO2

Sergio Tosoni et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2012)

Article Chemistry, Physical

TiO2/(CdS, CdSe, CdSeS) Nanorod Heterostructures and Photoelectrochemical Properties

Jingshan Luo et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2012)

Article Chemistry, Multidisciplinary

Photo-induced Charge Separation across the Graphene-TiO2 Interface Is Faster than Energy Losses: A Time-Domain ab lnitio Analysis

Run Long et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2012)

Article Chemistry, Physical

Theoretical Study of Adsorption of Ag Clusters on the Anatase TiO2(100) Surface

Aliaksei S. Mazheika et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2011)

Article Chemistry, Physical

CO Adsorption on Anatase Nanocrystals: A Combined Experimental and Periodic DFT Study

Lorenzo Mino et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2011)

Article Chemistry, Physical

Bulk and Surface Polarons in Photoexcited Anatase TiO2

Cristiana Di Valentin et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2011)

Article Chemistry, Physical

Transition levels of defect centers in ZnO by hybrid functionals and localized basis set approach

Federico Gallino et al.

JOURNAL OF CHEMICAL PHYSICS (2010)

Article Chemistry, Physical

Hydrogen Production by Photocatalytic Water Splitting over Pt/TiO2 Nanosheets with Exposed (001) Facets

Jiaguo Yu et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2010)

Review Chemistry, Multidisciplinary

Heterogeneous photocatalyst materials for water splitting

Akihiko Kudo et al.

CHEMICAL SOCIETY REVIEWS (2009)

Article Chemistry, Multidisciplinary

TiO2-graphene nanocomposites.: UV-assisted photocatalytic reduction of graphene oxide

Graeme Williams et al.

ACS NANO (2008)

Article Materials Science, Multidisciplinary

Photoluminescent properties of ZnS:Mn nanoparticles with in-built surfactant

Zinki Jindal et al.

JOURNAL OF MATERIALS SCIENCE (2008)

Article Chemistry, Applied

Visible-light photocatalytic activity of TiO2/ZnS nanocomposites prepared by homogeneous hydrolysis

Vaclav Stengl et al.

MICROPOROUS AND MESOPOROUS MATERIALS (2008)

Review Chemistry, Physical

TiO2 photocatalysis and related surface phenomena

Akira Fujishima et al.

SURFACE SCIENCE REPORTS (2008)

Article Chemistry, Physical

Surface studies of nitrogen implanted TiO2

Matthias Batzill et al.

CHEMICAL PHYSICS (2007)

Article Chemistry, Physical

N-doped TiO2:: Theory and experiment

Cristiana Di Valentin et al.

CHEMICAL PHYSICS (2007)

Article Materials Science, Multidisciplinary

Electronic properties of oxygen-deficient and aluminum-doped rutile TiO2 from first principles

Mazharul M. Islam et al.

PHYSICAL REVIEW B (2007)

Review Chemistry, Physical

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)

Article Chemistry, Multidisciplinary

Mesoporous Au/TiO2 nanocomposites with enhanced photocatalytic activity

Hexing Li et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2007)

Article Chemistry, Multidisciplinary

Origin of photoactivity of nitrogen-doped titanium dioxide under visible light

Stefano Livraghi et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2006)

Article Chemistry, Physical

Dogmas and misconceptions in heterogeneous photocatalysis. Some enlightened reflections

AV Emeline et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2005)

Article Chemistry, Applied

Photocatalytic activity of CU2O/TiO2, Bi2O3/TiO2 and ZnMn2O4/TiO2 heterojunctions

Y Bessekhouad et al.

CATALYSIS TODAY (2005)

Review Chemistry, Physical

Role of metal nanoparticles in TiO2/Ag nanocomposite-based microheterogeneous photocatalysis

PD Cozzoli et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2004)

Article Physics, Condensed Matter

Tubular structures of titanium disulfide TiS2

VV Ivanovskaya et al.

SOLID STATE COMMUNICATIONS (2004)

Article Chemistry, Multidisciplinary

Enhanced nitrogen doping in TiO2 nanoparticles

C Burda et al.

NANO LETTERS (2003)

Article Chemistry, Physical

Explaining the enhanced photocatalytic activity of Degussa P25 mixed-phase TiO2 using EPR

DC Hurum et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2003)

Article Chemistry, Physical

Surface structures and crystal morphology of ZnS: Computational study

S Hamad et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2002)

Article Materials Science, Multidisciplinary

Structure and energetics of stoichiometric TiO2 anatase surfaces -: art. no. 155409

M Lazzeri et al.

PHYSICAL REVIEW B (2001)

Article Chemistry, Multidisciplinary

Engineering of efficient panchromatic sensitizers for nanocrystalline TiO2-based solar cells

MK Nazeeruddin et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2001)