List of works - Zong-Yan Zhao

Band-edge electronic structure of β-In2S3: the role of s or p orbitals of atoms at different lattice positions

scientific article published on 14 March 2012

DFT study on the interfacial properties of vertical and in-plane BiOI/BiOIO3 hetero-structures.

scientific article published on 30 March 2017

Density functional theory study on the metal-support interaction between a Au9 cluster and an anatase TiO2(001) surface

scientific article published on 10 August 2017

Effects of crystal structure and composition on the photocatalytic performance of Ta-O-N functional materials.

scientific article published on 19 April 2018

Effects of the Preparation Process on the Photocatalytic Performance of Delafossite CuCrO2

scientific article published on 30 October 2020

Electronic Structure and Optical Properties of BiOI Ultrathin Films for Photocatalytic Water Splitting.

scientific article published on 29 October 2015

Electronic structure and optical properties of monoclinic clinobisvanite BiVO4

scientific article published on 31 January 2011

First-principles calculations on electronic structures of N/V-doped and N-V-dodoped anatase TiO2 (101) surfaces

scientific article published on 10 October 2012

Hexahedron Prism-Anchored Octahedronal CeO2: Crystal Facet-Based Homojunction Promoting Efficient Solar Fuel Synthesis.

scientific article published on 24 July 2015

High-yield synthesis of ultrathin and uniform Bi₂WO₆ square nanoplates benefitting from photocatalytic reduction of CO₂ into renewable hydrocarbon fuel under visible light

scientific article published on 23 August 2011

Insight into insulator-to-metal transition of sulfur-doped silicon by DFT calculations

scientific article published on 01 September 2014

Investigation of energy band alignments and interfacial properties of rutile NMO2/TiO2 (NM = Ru, Rh, Os, and Ir) by first-principles calculations

scientific article published on 30 October 2017

Mildly regulated intrinsic faradaic layer at the oxide/water interface for improved photoelectrochemical performance

scientific article published on 03 June 2020

Modification mechanism of praseodymium doping for the photocatalytic performance of TiO2: a combined experimental and theoretical study.

scientific article published in July 2015

Reconstruction of the (001) surface of TiO2 nanosheets induced by the fluorine-surfactant removal process under UV-irradiation for dye-sensitized solar cells ⬇️

scientific article published on April 14, 2012

Robustly photogenerating H2 in water using FeP/CdS catalyst under solar irradiation

scientific article

Spontaneous Polarization Effect and Photocatalytic Activity of Layered Compound of BiOIO3

scientific article published on 07 November 2019

Structural, Electronic, and Optical Properties of BiOX1-xYx (X, Y = F, Cl, Br, and I) Solid Solutions from DFT Calculations