List of works - Qiang Li

Accelerated discovery of stable lead-free hybrid organic-inorganic perovskites via machine learning

scientific article published in Nature Communications

Band-edge engineering via molecule intercalation: a new strategy to improve stability of few-layer black phosphorus.

scientific article published on 25 October 2017

Computation-aided Design of Single Atom Catalysts for One-pot CO2 Capture, Activation and Conversion

scientific article published on 19 October 2018

Covalent Functionalization of Black Phosphorus from First-Principles

scientific article published on 01 November 2016

Degenerate electron-doping in two-dimensional tungsten diselenide with a dimeric organometallic reductant

scientific article published in November 2019

Effect of illumination and Se vacancies on fast oxidation of ultrathin gallium selenide

scientific article published on 01 July 2018

Exploitation of the Large-Area Basal Plane of MoS2 and Preparation of Bifunctional Catalysts through On-Surface Self-Assembly.

scientific article

Hybrid Cu0 and Cux + as Atomic Interfaces Promote High-Selectivity Conversion of CO2 to C2 H5 OH at Low Potential

scientific article published on 13 June 2019

Metal-Free Single Atom Catalyst for N2 Fixation Driven by Visible Light

scientific article published on 17 October 2018

New Mechanism for N2 Reduction: The Essential Role of Surface Hydrogenation

scientific article published on 01 November 2019

Oxidation Mechanism and Protection Strategy of Ultrathin Indium Selenide: Insight from Theory.

scientific article published on 28 August 2017

Passivation of Black Phosphorus via Self-Assembled Organic Monolayers by van der Waals Epitaxy.

scientific article

Perspective on theoretical methods and modeling relating to electro-catalysis processes

scientific article published on 09 July 2020

Towards a Comprehensive Understanding of the Reaction Mechanisms Between Defective MoS2 and Thiol Molecules

scientific article

Unveiling chemical reactivity and oxidation of 1T-phased group VI disulfides

scientific article published on 26 July 2019

Water-Catalyzed Oxidation of Few-Layer Black Phosphorous in a Dark Environment.

scientific article published on 19 June 2017

List of works by Qiang Li

Accelerated discovery of stable lead-free hybrid organic-inorganic perovskites via machine learning

Band-edge engineering via molecule intercalation: a new strategy to improve stability of few-layer black phosphorus.

Computation-aided Design of Single Atom Catalysts for One-pot CO2 Capture, Activation and Conversion

Covalent Functionalization of Black Phosphorus from First-Principles

Degenerate electron-doping in two-dimensional tungsten diselenide with a dimeric organometallic reductant

Effect of illumination and Se vacancies on fast oxidation of ultrathin gallium selenide

Exploitation of the Large-Area Basal Plane of MoS2 and Preparation of Bifunctional Catalysts through On-Surface Self-Assembly.

Hybrid Cu0 and Cux + as Atomic Interfaces Promote High-Selectivity Conversion of CO2 to C2 H5 OH at Low Potential

Metal-Free Single Atom Catalyst for N2 Fixation Driven by Visible Light

New Mechanism for N2 Reduction: The Essential Role of Surface Hydrogenation

Oxidation Mechanism and Protection Strategy of Ultrathin Indium Selenide: Insight from Theory.

Passivation of Black Phosphorus via Self-Assembled Organic Monolayers by van der Waals Epitaxy.

Perspective on theoretical methods and modeling relating to electro-catalysis processes

Towards a Comprehensive Understanding of the Reaction Mechanisms Between Defective MoS2 and Thiol Molecules

Unveiling chemical reactivity and oxidation of 1T-phased group VI disulfides

Water-Catalyzed Oxidation of Few-Layer Black Phosphorous in a Dark Environment.