List of works - Hezhu Shao

A first-principles study on the phonon transport in layered BiCuOSe ⬇️

scientific article

Atomic scale study of stress-induced misaligned subsurface layers in KDP crystals

scientific article published on 18 July 2019

Electronic Band Structure and Sub-band-gap Absorption of Nitrogen Hyperdoped Silicon

scientific article

First-Principles Prediction of Ultralow Lattice Thermal Conductivity of Dumbbell Silicene: A Comparison with Low-Buckled Silicene

scientific article published on 27 July 2016

High intrinsic ZT in InP3 monolayer at room temperature

scientific article published on 24 May 2019

High thermoelectric performance in two-dimensional graphyne sheets predicted by first-principles calculations

scientific article published on 12 August 2015

Insights into High Conductivity of the Two-Dimensional Iodine-Oxidized sp2-c-COF

scientific article published on 05 December 2018

Low lattice thermal conductivity of stanene ⬇️

scientific article

Low-energy structures of clusters supported on metal fcc(110) surfaces.

scientific article published on 15 December 2011

Numerical solutions of the time-dependent Schrödinger equation: reduction of the error due to space discretization

scientific article published on 21 May 2009

Site-selective substitutional doping with atomic precision on stepped Al (111) surface by single-atom manipulation

scientific article

The conflicting role of buckled structure in phonon transport of 2D group-IV and group-V materials.

scientific article published on 20 March 2017

The role of Anderson's rule in determining electronic, optical and transport properties of transition metal dichalcogenide heterostructures

scientific article published on 01 December 2018

Theoretical understanding on band engineering of Mn-doped lead chalcogenides PbX (X = Te, Se, S)

scientific article published on 17 February 2015

Thermoelectric performance in a Si allotrope with ultralow thermal conductivity: a first-principles study combining phonon-limited electronic transport calculations

scientific article published in 2022

Water-mediated cation intercalation of open-framework indium hexacyanoferrate with high voltage and fast kinetics

scientific article published on 20 June 2016

List of works by Hezhu Shao

A first-principles study on the phonon transport in layered BiCuOSe ⬇️

Atomic scale study of stress-induced misaligned subsurface layers in KDP crystals

Electronic Band Structure and Sub-band-gap Absorption of Nitrogen Hyperdoped Silicon

First-Principles Prediction of Ultralow Lattice Thermal Conductivity of Dumbbell Silicene: A Comparison with Low-Buckled Silicene

High intrinsic ZT in InP3 monolayer at room temperature

High thermoelectric performance in two-dimensional graphyne sheets predicted by first-principles calculations

Insights into High Conductivity of the Two-Dimensional Iodine-Oxidized sp2-c-COF

Low lattice thermal conductivity of stanene ⬇️

Low-energy structures of clusters supported on metal fcc(110) surfaces.

Numerical solutions of the time-dependent Schrödinger equation: reduction of the error due to space discretization

Site-selective substitutional doping with atomic precision on stepped Al (111) surface by single-atom manipulation

The conflicting role of buckled structure in phonon transport of 2D group-IV and group-V materials.

The role of Anderson's rule in determining electronic, optical and transport properties of transition metal dichalcogenide heterostructures

Theoretical understanding on band engineering of Mn-doped lead chalcogenides PbX (X = Te, Se, S)

Thermoelectric performance in a Si allotrope with ultralow thermal conductivity: a first-principles study combining phonon-limited electronic transport calculations

Water-mediated cation intercalation of open-framework indium hexacyanoferrate with high voltage and fast kinetics