4.6 Article

The origins of charge separation in anisotropic facet photocatalysts investigated through first-principles calculations

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。
Review Green & Sustainable Science & Technology

State-of-the-art review of morphological advancements in graphitic carbon nitride (g-CN) for sustainable hydrogen production

Ritu Malik et al.

Summary: The passage discusses the importance and challenges of using solar energy for hydrogen generation through water splitting. It highlights the potential and limitations of a possible photocatalyst material, metal-free semiconductor graphitic carbon nitride (g-CN or g-C3N4), in this process.

RENEWABLE & SUSTAINABLE ENERGY REVIEWS (2021)

Article Optics

Electronic structure and optical properties in alkaline-earth metals (A = Mg, Ca, Ba) and Ir co-doped SrTiO3: A DFT + U investigation

Y. Q. Wang et al.

Summary: The study investigates the synergistic effects of alkaline-earth metals A (A = Mg, Ca, Ba) and Ir co-doping on the electronic structure and optical absorption properties of SrTiO3 using the GGA + Up+Ud method. It is found that the Mg/Ir and Ca/Ir co-doped SrTiO3 exhibit n-type semiconductor characteristics, while Ba/Ir co-doped SrTiO3 remains a p-type semiconductor. The results suggest that Ba/Ir co-doping could be a new way to enhance the photocatalytic activity of SrTiO3.
Review Chemistry, Multidisciplinary

Z-Scheme Photocatalytic Systems for Carbon Dioxide Reduction: Where Are We Now?

Wenhao Zhang et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2020)

Article Chemistry, Physical

Nature of SrTiO3/TiO2 (anatase) heterostructure from hybrid density functional theory calculations

Giovanni Di Liberto et al.

JOURNAL OF CHEMICAL PHYSICS (2020)

Review Materials Science, Multidisciplinary

Recent advances in g-C3N4-based heterojunction photocatalysts

Yunfeng Li et al.

JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY (2020)

Article Multidisciplinary Sciences

Photocatalytic water splitting with a quantum efficiency of almost unity

Tsuyoshi Takata et al.

NATURE (2020)

Editorial Material Chemistry, Multidisciplinary

Anatase/Bronze TiO2 Heterojunction: Enhanced Photocatalysis and Prospect in Photothermal Catalysis

Changhua Wang et al.

CHEMICAL RESEARCH IN CHINESE UNIVERSITIES (2020)

Review Chemistry, Multidisciplinary

Black TiO2 Synthesis by Chemical Reduction Methods for Photocatalysis Applications

Luminita Andronic et al.

FRONTIERS IN CHEMISTRY (2020)

Review Chemistry, Physical

A Mini Review on Bismuth-Based Z-Scheme Photocatalysts

Ruizhen Li et al.

MATERIALS (2020)

Review Chemistry, Physical

The role of oxygen vacancies in water splitting photoanodes

Roser Fernandez-Climent et al.

SUSTAINABLE ENERGY & FUELS (2020)

Article Engineering, Environmental

An overview of strategies for enhancement in photocatalytic oxidative ability of MoS2 for water purification

Vasudha Hasija et al.

JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING (2020)

Review Chemistry, Physical

Defect engineering in photocatalysis: formation, chemistry, optoelectronics, and interface studies

Dileep Maarisetty et al.

JOURNAL OF MATERIALS CHEMISTRY A (2020)

Article Materials Science, Multidisciplinary

Fully anharmonic nonperturbative theory of vibronically renormalized electronic band structures

Marios Zacharias et al.

PHYSICAL REVIEW B (2020)

Review Engineering, Environmental

Photodegradation of organic pollutants using heterojunctions: A review

Parul Kamalpreet Kaur et al.

JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING (2020)

Article Physics, Condensed Matter

Efficient Visible-Light-Induced Photocatalytic Activity of SrTiO3 Co-Doped With Os and N: A GGA plus U Investigation

Yueqin Wang et al.

PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS (2019)

Review Chemistry, Multidisciplinary

Design and tailoring of one-dimensional ZnO nanomaterials for photocatalytic degradation of organic dyes: a review

Morasae Samadi et al.

RESEARCH ON CHEMICAL INTERMEDIATES (2019)

Article Chemistry, Multidisciplinary

Unprecedented Eighteen-Faceted BiOCl with a Ternary Facet Junction Boosting Cascade Charge Flow and Photo-redox

Min Li et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2019)

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 Materials Science, Multidisciplinary

Controllable synthesis of BiVO4 with a homojunction of (110) and (040) crystal facets for photocatalytic degradation of Rhodamine B

Jingjing Yang et al.

MATERIALS RESEARCH EXPRESS (2019)

Article Chemistry, Physical

Efficient facet regulation of BiVO4 and its photocatalytic motivation

Lianwei Shan et al.

JOURNAL OF ALLOYS AND COMPOUNDS (2019)

Review Chemistry, Multidisciplinary

Carbon-Based Nanomaterials via Heterojunction Serving as Photocatalyst

Noureen Syed et al.

FRONTIERS IN CHEMISTRY (2019)

Review Chemistry, Physical

Review on Metal Sulphide-based Z-scheme Photocatalysts

Tingmin Di et al.

CHEMCATCHEM (2019)

Review Chemistry, Physical

Photocatalysis with Reduced TiO2: From Black TiO2 to Cocatalyst-Free Hydrogen Production

Alberto Naldoni et al.

ACS CATALYSIS (2019)

Review Chemistry, Applied

A review on tungsten-trioxide-based photoanodes for water oxidation

Jingwei Huang et al.

CHINESE JOURNAL OF CATALYSIS (2019)

Review Chemistry, Physical

Defect engineering in photocatalytic materials

Song Bai et al.

NANO ENERGY (2018)

Article Chemistry, Inorganic & Nuclear

The Controllable Synthesis of Octadecahedral BiVO4 with Exposed {111} Facets

Yifeng Zhang et al.

EUROPEAN JOURNAL OF INORGANIC CHEMISTRY (2017)

Article Nanoscience & Nanotechnology

Electronic Structure and Band Alignment at the NiO and SrTiO3 p-n Heterojunctions

Kelvin H. L. Zhang et al.

ACS APPLIED MATERIALS & INTERFACES (2017)

Article Chemistry, Multidisciplinary

Enhancing charge separation on high symmetry SrTiO3 exposed with anisotropic facets for photocatalytic water splitting

Linchao Mu et al.

ENERGY & ENVIRONMENTAL SCIENCE (2016)

Article Physics, Multidisciplinary

Interface Structure, Band Alignment, and Built-In Potentials at LaFeO3/n-SrTiO3 Heterojunctions

Ryan Comes et al.

PHYSICAL REVIEW LETTERS (2016)

Article Chemistry, Multidisciplinary

Charge separation by tetrahexahedron-SrTiO3/TiO2 heterojunction as an efficient photocatalyst

Morteza Afshar et al.

RESEARCH ON CHEMICAL INTERMEDIATES (2016)

Article Chemistry, Multidisciplinary

Direct Imaging of Highly Anisotropic Photogenerated Charge Separations on Different Facets of a Single BiVO4 Photocatalyst

Jian Zhu et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2015)

Review Chemistry, Multidisciplinary

Defect chemistry and defect engineering of TiO2-based semiconductors for solar energy conversion

Janusz Nowotny et al.

CHEMICAL SOCIETY REVIEWS (2015)

Review Materials Science, Multidisciplinary

Error Estimates for Solid-State Density-Functional Theory Predictions: An Overview by Means of the Ground-State Elemental Crystals

K. Lejaeghere et al.

CRITICAL REVIEWS IN SOLID STATE AND MATERIALS SCIENCES (2014)

Article Chemistry, Physical

Correlation Effects on Lattice Relaxation and Electronic Structure of ZnO within the GGA plus U Formalism

Xinguo Ma et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2013)

Article Multidisciplinary Sciences

Spatial separation of photogenerated electrons and holes among {010} and {110} crystal facets of BiVO4

Rengui Li et al.

NATURE COMMUNICATIONS (2013)

Review Chemistry, Multidisciplinary

Stability of Polymer Solar Cells

Mikkel Jorgensen et al.

ADVANCED MATERIALS (2012)

Article Physics, Applied

Effects of doping on the lattice parameter of SrTiO3

Anderson Janotti et al.

APPLIED PHYSICS LETTERS (2012)

Article Chemistry, Multidisciplinary

On the True Photoreactivity Order of {001}, {010}, and {101} Facets of Anatase TiO2 Crystals

Jian Pan et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2011)

Article Chemistry, Multidisciplinary

Crystal facet engineering of semiconductor photocatalysts: motivations, advances and unique properties

Gang Liu et al.

CHEMICAL COMMUNICATIONS (2011)

Article Chemistry, Multidisciplinary

Evidence for Crystal-Face-Dependent TiO2 Photocatalysis from Single-Molecule Imaging and Kinetic Analysis

Takashi Tachikawa et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2011)

Article Multidisciplinary Sciences

Anatase TiO2 single crystals with a large percentage of reactive facets

Hua Gui Yang et al.

NATURE (2008)

Review Energy & Fuels

Stability/degradation of polymer solar cells

Mikkel Jorgensen et al.

SOLAR ENERGY MATERIALS AND SOLAR CELLS (2008)

Article Chemistry, Physical

Hole localization in al doped silica:: A DFT+U description

Michael Nolan et al.

JOURNAL OF CHEMICAL PHYSICS (2006)

Article Materials Science, Multidisciplinary

Oxidation energies of transition metal oxides within the GGA+U framework

Lei Wang et al.

PHYSICAL REVIEW B (2006)

Article Crystallography

First principles methods using CASTEP

SJ Clark et al.

ZEITSCHRIFT FUR KRISTALLOGRAPHIE (2005)

Article Materials Science, Multidisciplinary

Photoelectron energy-loss functions of SrTiO3, BaTiO3, and TiO2:: Theory and experiment -: art. no. 085101

M Arai et al.

PHYSICAL REVIEW B (2002)

Article Chemistry, Multidisciplinary

Crystal faces of rutile and anatase TiO2 particles and their roles in photocatalytic reactions

T Ohno et al.

NEW JOURNAL OF CHEMISTRY (2002)

Article Physics, Applied

Bulk electronic structure of SrTiO3:: Experiment and theory

K van Benthem et al.

JOURNAL OF APPLIED PHYSICS (2001)