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List of works by Wenhui Duan

A Chemical Modification Strategy for Hydrogen Storage in Covalent Organic Frameworks

A few-layered Ti3C2 nanosheet/glass fiber composite separator as a lithium polysulphide reservoir for high-performance lithium–sulfur batteries

A first principles interatomic potential and application to the grain boundary in Ni

A general group theoretical method to unfold band structures and its application ⬇️

Ab initio Study of Half-Metallicity and Magnetism of Complex Organometallic Molecular Wires

Ab initio study of beryllium-decorated fullerenes for hydrogen storage

Ab initio study of transport properties of multiwalled carbon nanotubes

scholarly article in Physical Review B, vol. 72 no. 15, October 2005

Acoustic phonon mode splitting behavior of an asymmetric y-branch three terminal junction

Acoustic phonon transport through a T-shaped quantum waveguide

scientific article published in July 2004

Activated dissociation ofO2on Pb(111) surfaces by Pb adatoms

scholarly article in Physical Review B, vol. 80 no. 7, August 2009

Adsorption of DNA/RNA nucleobases on hexagonal boron nitride sheet: an ab initio study

scientific article published on 03 June 2011

Adsorption of Gas Molecules on Graphene Nanoribbons and Its Implication for Nanoscale Molecule Sensor

Alkali-Metal-Doped B80 as High-Capacity Hydrogen Storage Media

article published in 2008

All-optical Fresnel lens in coherent media: controlling image with image

scientific article published on 01 January 2011

All-optical beam control with high speed using image-induced blazed gratings in coherent media

Anisotropic Full-Gap Superconductivity in 2M-WS<sub>2</sub> Topological Metal with Intrinsic Proximity Effect

scientific article published on 30 December 2020

Anomalous properties of antiferroelectricPbZrO3under hydrostatic pressure

scholarly article in Physical Review B, vol. 89 no. 21, June 2014

Anomalous properties of hexagonal rare-earth ferrites from first principles

scholarly article in Physical Review B, vol. 89 no. 20, May 2014

Atomic Mechanism of Hybridization-Dependent Surface Reconstruction with Tailored Functionality in Hexagonal Multiferroics.

scientific article published on 21 July 2017

Atomic-vacancy effects on field electron emission of carbon nanotubes: A first-principles study

Band Engineering of Dirac Surface States in Topological-Insulator-Based van der Waals Heterostructures

scientific article published on 23 September 2015

Beryllium-dihydrogen complexes on nanostructures

Bonding modes and electronic properties of single-crystalline silicon nanotubes

scholarly article in Physical Review B, vol. 73 no. 15, April 2006

Chemical Functionalization of Carbon Nanotubes by Carboxyl Groups on Stone-Wales Defects: A Density Functional Theory Study

scientific article published on 01 June 2006

Chemical composition fluctuations at interfaces in quantum well structures: effect on interface phonon modes

article

Chemical-potential-dependent gap opening at the Dirac surface states of Bi2Se3 induced by aggregated substitutional Cr atoms

scientific article published on 6 February 2014

Coexistence of Superconductivity with Enhanced Charge Density Wave Order in the Two-Dimensional Limit of TaSe2

scientific article published on 09 July 2019

Comment on “Structural and Electronic Properties ofTGraphene: A Two-Dimensional Carbon Allotrope with Tetrarings”

scientific article published on 08 January 2013

Continuous, Ultra-lightweight, and Multipurpose Super-aligned Carbon Nanotube Tapes Viable over a Wide Range of Temperatures

scientific article published on 21 June 2019

Converting normal insulators into topological insulators via tuning orbital levels ⬇️

scholarly article in Physical Review B, vol. 92 no. 20, November 2015

Deep-learning density functional theory Hamiltonian for efficient ab initio electronic-structure calculation

scientific article published in 2022

Defect energetics and magnetic properties of 3d-transition-metal-doped topological crystalline insulator SnTe

Design of strain-engineered quantum tunneling devices for topological surface states

Deterministic Role of Concentration Surplus of Cation Vacancy over Anion Vacancy in Bipolar Memristive NiO.

scientific article published on 20 April 2016

Dielectric properties of relaxor ferroelectric films

Dimensional effects on field emission properties of the body for single-walled carbon nanotube

Dirac fermions in strongly bound graphene systems

scientific article published on 14 November 2012

Direct observation of spin-layer locking by local Rashba effect in monolayer semiconducting PtSe2 film

scientific article published on 31 January 2017

Discovery of robust in-plane ferroelectricity in atomic-thick SnTe.

scientific article published in July 2016

D−centers in spherical quantum dots

scientific article published on 01 September 1992

Edge States of Zigzag Boron Nitride Nanoribbons

Edge stability of boron nitride nanoribbons and its application in designing hybrid BNC structures

Effect of Hartree–Fock pseudopotentials on local density functional theory calculations

scientific article published on 01 July 2018

Effect of an electric field on electron-interface-phonon scattering in a graded quantum well

Effect of defect-induced internal field on the aging of relaxors

scholarly article in Physical Review B, vol. 67 no. 5, February 2003

Effect of defects on the thermal conductivity in a nanowire

scholarly article in Physical Review B, vol. 72 no. 4, July 2005

Effect of substitutional atoms in the tip on field-emission properties of capped carbon nanotubes

Effect of tunneling frequency on relaxor behavior

Effective chemical potential for non-equilibrium systems and its application to molecular beam epitaxy of Bi2Se3

Effects of ferroelectric polarization on surface phase diagram: Evolutionary algorithm study of theBaTiO3(001) surface ⬇️

scholarly article in Physical Review B, vol. 92 no. 8, August 2015

Effects of finite deformed length in carbon nanotubes

Effects of hydrostatic pressure on Pb(Zr1−xTix)O3 near the morphotropic phase boundary

Effects of strain and oxygen vacancies on the ferroelectric and antiferrodistortive distortions inPbTiO3/SrTiO3superlattice

scholarly article in Physical Review B, vol. 92 no. 11, September 2015

Effects of vacancy-carboxyl pair functionalization on electronic properties of carbon nanotubes

article published in 2006

Elastic Properties and Fracture Behaviors of Biaxially Deformed, Polymorphic MoTe2

scientific article published on 14 January 2019

Elastic properties of tetragonal BiFeO3 from first-principles calculations

Electric-field-dependent intersubband transition via optical phonons in a doped-thin-layer inserted quantum-well structure

scientific article published on 01 December 1996

Electrically tunable multiple Dirac cones in thin films of the (LaO)2(SbSe2)2 family of materials. ⬇️

scientific article

Electron Emission Originated from Free-Electron-like States of Alkali-Doped Boron−Nitride Nanotubes

scientific article published on 01 December 2008

Electron-phonon scattering inGa1−xAlxAs quantum-well structures in an electric field

scientific article published on 01 August 1994

Electronic Phase Diagram of Single-Element Silicon “Strain” Superlattices

scientific article published on 02 July 2010

Electronic States and Magnetic Response of MnBi2Te4 by Scanning Tunneling Microscopy and Spectroscopy

scientific article published on 16 April 2020

Electronic Strengthening of Graphene by Charge Doping

scientific article published on 27 November 2012

Electronic analog of chiral metamaterial: Helicity-resolved filtering and focusing of Dirac fermions in thin films of topological materials

scholarly article in Physical Review B, vol. 92 no. 4, July 2015

Electronic and crystal structure changes induced by in-plane oxygen vacancies in multiferroicYMnO3

scholarly article in Physical Review B, vol. 93 no. 5, February 2016

Electronic and magnetic properties of early transition-metal substituted iron-cyclopentadienyl sandwich molecular wires: Parity-dependent half-metallicity

scientific article published on 01 July 2011

Electronic and magnetic properties of partially open carbon nanotubes

scientific article published on December 2009

Electronic structure and field-emission characteristics of open-ended single-walled carbon nanotubes.

scientific article

Electronic structure of silicene on Ag(111): Strong hybridization effects

scholarly article in Physical Review B, vol. 88 no. 3, July 2013

Electronic transport mechanism of a molecular electronic device: structural effects and terminal atoms

Electronic-structure theory of crystalline insulators under a homogeneous electric field

scholarly article in Physical Review B, vol. 69 no. 8, February 2004

Electron–interface-phonon scattering in graded quantum wells ofGa1−xAlxAs

scientific article published on 01 May 1994

Electron–optical–phonon scattering in non-square quantum-well structures

Emergence of a Chern-insulating state from a semi-Dirac dispersion ⬇️

scholarly article in Physical Review B, vol. 92 no. 16, October 2015

Emission probabilities of π electrons in carbon naonotubes

Energy gaps of atomically precise armchair graphene sidewall nanoribbons

scholarly article in Physical Review B, vol. 93 no. 24, June 2016

Enhanced performance of lithium-sulfur batteries with an ultrathin and lightweight MoS2/carbon nanotube interlayer

Enhanced thermoelectric figure of merit in thin GaAs nanowires

scientific article published in May 2015

Enhancement of thermoelectric properties in graphene nanoribbons modulated with stub structures

Evolution of Ni nanofilaments and electromagnetic coupling in the resistive switching of NiO.

scientific article published in January 2015

Experimental observation of Dirac-like surface states and topological phase transition in Pb(1-x)Sn(x)Te(111) films. ⬇️

scientific article published on 5 May 2014

Experimental observation of quantum oscillation of surface chemical reactivities

scholarly article

Ferroelectricity inPb(Zr0.5Ti0.5)O3thin films: Critical thickness and 180° stripe domains

scholarly article in Physical Review B, vol. 70 no. 10, September 2004

Field emission in doped nanotubes

scientific article

Field-Effect Birefringent Spin Lens in Ultrathin Film of Magnetically Doped Topological Insulators

scientific article published on 10 September 2013

Finite size effects in carbon nanotubes

Finite-size effects and spin texture of hourglass fermions in KHgSb films

scholarly article in Physical Review B, vol. 95 no. 23, June 2017

First-principles calculations on the effect of doping and biaxial tensile strain on electron-phonon coupling in graphene

scientific article published on 6 November 2013

First-principles investigation into the structural stability of icosahedral Ti12X clusters (X B, C, N, Al, Si, P, V, Cr, Mn, Fe, Co and Ni)

First-principles search for high-pressure phases ofGaAsO4

scholarly article in Physical Review B, vol. 60 no. 6, August 1999

First-principles studies of the local structure and relaxor behavior of Pb(Mg1/3Nb2/3)O3−PbTiO3 -derived ferroelectric perovskite solid solutions

scholarly article in Physical Review B, vol. 97 no. 17, May 2018

First-principles study of high-pressure alumina polymorphs

scholarly article in Physical Review B, vol. 57 no. 17, May 1998

First-principles study of hydrogenated carbon nanotubes: A promising route for bilayer graphene nanoribbons

First-principles study of line-defect-embedded zigzag graphene nanoribbons: electronic and magnetic properties

scientific article published on 18 April 2016

First-principles study of the stability of the icosahedralTi13,Ti13−1,andTi13+1clusters

scholarly article in Physical Review B, vol. 65 no. 16, April 2002

First-principles study of180∘domain walls inBaTiO3: Mixed Bloch-Néel-Ising character

scholarly article in Physical Review B, vol. 90 no. 5, August 2014

First-principles study on morphology and mechanical properties of single-walled carbon nanotube

Flip motion of heterogeneous buckled dimers on Ge(001) by electron injection from STM tip

Formation, Morphology, and Effect of Complex Defects in Boron Nitride Nanotubes: An ab initio Calculation

Functionalized germanene as a prototype of large-gap two-dimensional topological insulators ⬇️

scholarly article in Physical Review B, vol. 89 no. 11, March 2014

General criterion to distinguish between Schottky and Ohmic contacts at the metal/two-dimensional semiconductor interface

scientific article published on 24 January 2017

Generation of narrow-band terahertz radiation with preset frequency components in poled ferroelectric materials

Generation of tunable-volume transmission-holographic gratings at low light levels

article

Giant room-temperature spin caloritronics in spin-semiconducting graphene nanoribbons

scholarly article in Physical Review B, vol. 90 no. 12, September 2014

Graphene oxide as a sulfur immobilizer in high performance lithium/sulfur cells

scientific article published in November 2011

Growth of atomically thick transition metal sulfide filmson graphene/6H-SiC(0001) by molecular beam epitaxy

Half metallicity along the edge of zigzag boron nitride nanoribbons

scholarly article in Physical Review B, vol. 78 no. 20, November 2008

Hexagonal rare-earth manganites and ferrites: a review of improper ferroelectricity, magnetoelectric coupling, and unusual domain walls

scientific article published on 25 June 2020

High-Rate, Ultralong Cycle-Life Lithium/Sulfur Batteries Enabled by Nitrogen-Doped Graphene

scientific article published on 31 July 2014

High-Resolution Scanning Tunneling Spectroscopy of Magnetic Impurity Induced Bound States in the Superconducting Gap of Pb Thin Films

scientific article published in Physical Review Letters

High-resolution x-ray absorption studies of core excitons in hexagonal boron nitride

scholarly article

Huge Enhancement of Electromechanical Responses in Compositionally ModulatedPb(Zr1−x Tix)O3

article

Hydrogen storage in Ca-decorated, B-substituted metal organic framework

Hydrogen storage in alkali-metal-decorated organic molecules

Hydrogen-induced metallicity ofSrTiO3(001) surfaces: A density functional theory study

scholarly article in Physical Review B, vol. 79 no. 3, January 2009

Hydrogen-induced metallization of zinc oxide(21¯1¯0)surface and nanowires: The effect of curvature

scholarly article in Physical Review B, vol. 77 no. 24, June 2008

Hydrostatic-pressure-induced porous gallium nitride from nanotube bundles: An ab initio study

scientific article published on 01 November 2006

Identifying Dirac cones in carbon allotropes with square symmetry

scientific article published in November 2013

Impact of structural defects on the localized acoustic wave in superlattices

Improving the optical absorption of BiFeO3 for photovoltaic applications via uniaxial compression or biaxial tension

Influence of the structural defects on localized interface optical-phonon modes in periodically layered heterostructures

Interface engineering of epitaxial graphene on SiC(0001¯) via fluorine intercalation: A first principles study

Interface reconstruction with emerging charge ordering in hexagonal manganite.

scientific article

Interfacial thermal conductance of partially unzipped carbon nanotubes: Linear scaling and exponential decay

scholarly article in Physical Review B, vol. 87 no. 15, April 2013

Interlayer interactions in graphites

scientific article

Intrasubband electron-phonon scattering in doped thin-layer inserted quantum well

Intrinsic anisotropy of thermal conductance in graphene nanoribbons

Intrinsic current-voltage characteristics of graphene nanoribbon transistors and effect of edge doping

scientific article published on 27 April 2007

Intrinsic half-metallic BN–C nanotubes

article published in 2010

Intrinsic magnetic topological insulators in van der Waals layered MnBi2Te4-family materials.

scientific article published on 14 June 2019

Large negative thermal expansion in non-perovskite lead-free ferroelectric Sn2P2S6.

scientific article published on 8 February 2016

Large-Gap Quantum Spin Hall Insulators in Tin Films

scientific article (publication date: 24 September 2013)

Level width of a quasibound state in a double-barrier parabolic-well resonant tunneling structure

Local Vibrational Excitation through Extended Electronic States at a Germanium Surface

scientific article published on 21 December 2009

Localized interface optical phonon modes in a semi-infinite superlattice with a cap layer

Localized interface optical-phonon modes in two coupled semi-infinite superlattices

Localized mixed acoustic modes in non-cubic-axial superlattice with a cap layer

Long periodic oscillation of electronic properties in capped finite-length armchair carbon nanotubes

scholarly article in Physical Review B, vol. 71 no. 7, February 2005

Long-range interaction between Stone-Wales defects in zigzag single-walled carbon nanotubes

scholarly article in Physical Review B, vol. 72 no. 19, November 2005

Lorentz-violating type-II Dirac fermions in transition metal dichalcogenide PtTe2.

scientific article published on 15 August 2017

Low-energy transmission electron diffraction and imaging of large-area graphene.

scientific article published on September 2017

Magnetism of C Adatoms on BN Nanostructures: Implications for Functional Nanodevices

scientific article published on 01 February 2009

Magnetostructural effects and phase transition inCr2O3under pressure

scholarly article in Physical Review B, vol. 62 no. 18, November 2000

Making a field effect transistor on a single graphene nanoribbon by selective doping

article

Manipulating the Kondo Resonance through Quantum Size Effects

scientific article published on 20 December 2007

Manipulating topological phase transition by strain

scientific article published on 31 January 2014

Manipulation of Magnetic Properties by Oxygen Vacancies in Multiferroic YMnO3

Mechanism of nanoelectronic switch based on telescoping carbon nanotubes

Metal-to-Semiconductor Transition in Squashed Armchair Carbon Nanotubes

scientific article published on 18 April 2003

Metallicity retained by covalent functionalization of graphene with phenyl groups

scientific article

Microscopic origin of thep-type conductivity of the topological crystalline insulator SnTe and the effect of Pb alloying

scholarly article in Physical Review B, vol. 89 no. 4, January 2014

Modulating the Electronic Properties of Graphene by Self-Organized Sulfur Identical Nanoclusters and Atomic Superlattices Confined at an Interface

scientific article published on 27 September 2018

Modulating transmission properties of nanoscale transistors by dipoles near contacts

article

Molecular Beam Epitaxy-Grown SnSe in the Rock-Salt Structure: An Artificial Topological Crystalline Insulator Material

scientific article published on 8 June 2015

Molecular and atomic adsorption of hydrogen on TiO 2 nanotubes: An ab initio study

Multi-ion Modulated Single-Step Synthesis of a Nanocarbon Embedded with a Defect-Rich Nanoparticle Catalyst for a High Loading Sulfur Cathode

scientific article published on 04 March 2020

Multifunctional Interlayer Based on Molybdenum Diphosphide Catalyst and Carbon Nanotube Film for Lithium-Sulfur Batteries.

scientific article published on 27 December 2017

Multiple localized states and magnetic orderings in partially open zigzag carbon nanotube superlattices: An ab initio study

scientific article published on 01 August 2010

Multiple tunneling channels order-disorder ferroelectric model and field-induced phase transition in relaxors

scholarly article in Physical Review B, vol. 65 no. 17, May 2002

Narrowed bandgaps and stronger excitonic effects from small boron nitride nanotubes

scholarly article

Nonequilibrium Green’s function method for phonon-phonon interactions and ballistic-diffusive thermal transport

scholarly article in Physical Review B, vol. 78 no. 22, December 2008

NontrivialZ2topology in bismuth-based III-V compounds

scholarly article by Huaqing Huang et al published 4 November 2014 in Physical Review B

Optical Transitions in Ruby across the Corundum toRh2O3(II) Phase Transformation

Optimizing photoelectrochemical properties ofTiO2by chemical codoping

scholarly article in Physical Review B, vol. 82 no. 19, November 2010

Orientation-dependent charge carrier confinement in a nanopatterned silicon film

Oxidation of carbon monoxide on Rh(111): a density functional theory study.

scientific article published in June 2006

Phase diagram of ferroelectric BaTiO3ultrathin films under open-circuit conditions

Phase diagram of ultrathin Pb(Zr0.5Ti0.5)O3 films under strain

Phonon transport and thermal conductivity in dielectric quantum wire

Phonon-mediated high-T c superconductivity in hole-doped diamond-like crystalline hydrocarbon.

scientific article

Photon-assisted thermoelectric properties of noncollinear spin valves

scholarly article in Physical Review B, vol. 87 no. 8, February 2013

Physical Origin of Hydrogen-Adsorption-Induced Metallization of the SiC Surface:n-Type Doping via Formation of Hydrogen Bridge Bond

scientific article published on 31 October 2005

Physical mechanism of transport blocking in metallic zigzag carbon nanotubes

scholarly article in Physical Review B, vol. 75 no. 20, May 2007

Plasmons of topological crystalline insulator SnTe with nanostructured patterns

scholarly article in RSC Advances, vol. 6 no. 61, 2016

Prediction of Stoner-Type Magnetism in Low-Dimensional Electrides

article published in 2019

Prediction of a stable post-post-perovskite structure from first principles ⬇️

scholarly article in Physical Review B, vol. 91 no. 2, January 2015

Prediction of silicon-based room temperature quantum spin Hall insulator via orbital mixing

Preparing spin-polarized scanning tunneling microscope probes on capped carbon nanotubes by Fe doping: A first-principles study

Pressure and strain effects of hexagonal rare-earth manganites: a first-principles study

scientific article published on 26 February 2016

Pressure-Induced Multiferroics via Pseudo Jahn-Teller Effects and Novel Couplings

Probing Superexchange Interaction in Molecular Magnets by Spin-Flip Spectroscopy and Microscopy

scientific article published on 07 November 2008

Qualitative and quantitative descriptions on the localized electronic structure in single-walled carbon nanotubes

Quantized thermal conductance at low temperatures in quantum wire with catenoidal contacts

scholarly article in Physical Review B, vol. 81 no. 19, May 2010

Quantum Manifestations of Graphene Edge Stress and Edge Instability: A First-Principles Study

scientific article published on 22 April 2009

Quantum Unfolding: A program for unfolding electronic energy bands of materials ⬇️

Quantum confinement of crystalline silicon nanotubes with nonuniform wall thickness: Implication to modulation doping

Quasi-1D topological insulators

scientific article published on 01 February 2016

Realizing an intrinsic excitonic insulator by decoupling exciton binding energy from the minimum band gap

scholarly article in Physical Review B, vol. 98 no. 8, August 2018

ReleasingH2molecules with a partial pressure difference without the use of temperature

scholarly article in Physical Review B, vol. 82 no. 8, August 2010

Resolving Deep Quantum-Well States in Atomically Thin 2H-MoTe2 Flakes by Nanospot Angle-Resolved Photoemission Spectroscopy

scientific article published on 19 July 2018

Resonant Tunneling in an Aharonov-Bohm Ring with a Quantum Dot

Revealing the Topology of Fermi-Surface Wave Functions from Magnetic Quantum Oscillations

Robust Gapless Surface State and Rashba-Splitting Bands upon Surface Deposition of Magnetic Cr on Bi2Se3 ⬇️

scientific article published on 02 March 2015

Robust linear dependence of thermal conductance on radial strain in carbon nanotubes

Role of Symmetry in the Transport Properties of Graphene Nanoribbons under Bias

article

Room-temperature dissociative hydrogen chemisorption on boron-doped fullerenes

scholarly article in Physical Review B, vol. 77 no. 23, June 2008

Saddle-Point Excitons and Their Extraordinary Light Absorption in 2D β-Phase Group-IV Monochalcogenides

Scaling Universality between Band Gap and Exciton Binding Energy of Two-Dimensional Semiconductors

scientific article published on 27 June 2017

Scaling law of the giant Stark effect in boron nitride nanoribbons and nanotubes

scholarly article in Physical Review B, vol. 78 no. 8, August 2008

Scattering potentials at Si-Ge and Sn-Ge impurity dimers on Ge(001) studied by scanning tunneling microscopy andab initiocalculations

scholarly article in Physical Review B, vol. 78 no. 8, August 2008

Selective adsorption of first-row atoms on BN nanotubes

Self-organization nanodomain structure in ferroelectric ultrathin films

Single electron emission from the closed-tips of single-walled carbon nanotubes.

scientific article published in December 2004

Single layer lead iodide: computational exploration of structural, electronic and optical properties, strain induced band modulation and the role of spin-orbital-coupling

scientific article published on 27 August 2015

Soft modes in order–disorder ferroelectrics

Spin-Triplet Excitonic Insulator: The Case of Semihydrogenated Graphene

scientific article published on 01 April 2020

Spin-filtered edge states with an electrically tunable gap in a two-dimensional topological crystalline insulator.

scientific article

Spin-polarized electron current from Mn-doped closed zigzag GaN nanotubes

Spin-polarized electron current from carbon-doped open armchair boron nitride nanotubes: Implication for nano-spintronic devices

Spin-polarized electron emitter: Mn-doped GaN nanotubes and their arrays

scholarly article in Physical Review B, vol. 69 no. 11, March 2004

Spontaneous edge-defect formation and defect-induced conductance suppression in graphene nanoribbons

scholarly article in Physical Review B, vol. 82 no. 11, September 2010

Spontaneous polarizations of ultrashort-period epitaxial KNbO3∕(KTaO3)m superlattices: An ab initio investigation

Stability investigations on the non-vdW-exfoliated surfaces of the topological insulatorBi2Te3: A first-principles study

scholarly article in Physical Review B, vol. 93 no. 11, March 2016

Stable Dirac semimetal in the allotropes of group-IV elements ⬇️

scholarly article in Physical Review B, vol. 93 no. 24, June 2016

Stable NontrivialZ2Topology in Ultrathin Bi (111) Films: A First-Principles Study

scientific article published on 23 September 2011

Stable two-dimensional dumbbell stanene: A quantum spin Hall insulator

scholarly article in Physical Review B, vol. 90 no. 12, September 2014

Stochastic resonance induced by random fields in ferroelectrics

Structural and electronic phase transitions in ferromagnetic monolayer VS2 induced by charge doping

scholarly article in Physical Review B, vol. 95 no. 20, May 2017

Structural and electronic properties of Ge-Si, Sn-Si, and Pb-Si dimers on Si(001) from density-functional calculations

scientific article published on 26 June 2009

Structural and electronic properties of fluorinated double-walled boron nitride nanotubes: Effect of interwall interaction

scholarly article in Physical Review B, vol. 75 no. 12, March 2007

Structural and electronic properties ofn-doped andp-dopedSrTiO3

scholarly article in Physical Review B, vol. 70 no. 21, December 2004

Structural characterizations and electronic properties of boron nitride nanotube crystalline bundles

scientific article published on 01 September 2005

Structural phase transition and electronic structure evolution in Ir 1–x Pt x Te 2 studied by scanning tunneling microscopy

Structural stability and topological surface states of the SnTe (111) surface

scholarly article in Physical Review B, vol. 89 no. 12, March 2014

Structural transition of large lead monoxide clusters

Structural trends interpretation of the metal-to-semiconductor transition in deformed carbon nanotubes

Structural, electronic, and magnetic properties of manganese-doped Zn12O12 clusters: A first-principles study

scientific article published on 01 May 2006

Structures and stabilities of small lead oxide clusters PbmOn (m=1–4,n=1–2m)

scientific article published on 01 April 2007

Study of structure characteristics of the Ga8As8 cluster

Sulfur immobilization and lithium storage on defective graphene: A first-principles study

Suppression of spin polarization in graphene nanoribbons by edge defects and impurities

scholarly article in Physical Review B, vol. 77 no. 15, April 2008

Surface symmetry breaking and disorder effects on superconductivity in perovskite BaBi3 epitaxial films

scholarly article in Physical Review B, vol. 98 no. 6, August 2018

Tailoring Native Defects and Zinc Impurities in Li4Ti5O12: Insights from First-Principles Study

The Half-Metallicity of Zigzag Graphene Nanoribbons with Asymmetric Edge Terminations

scientific article published on 01 August 2010

The Study on the Filling of Atoms in a Carbon Nanotube

The adsorption of O2 on Pb films and the effect of quantum modulation: A first-principles prediction

scientific article published on 01 April 2008

The effects of oxygen substitution on electronic structure of single-walled carbon nanotubes

Theoretical investigation of the negative differential resistance in squashed C60 molecular device

Theoretical studies on the electronic structure of Ti8C12 isomers

scientific article published on 01 September 2004

Theory of the Dirac half metal and quantum anomalous Hall effect in Mn-intercalated epitaxial graphene ⬇️

scientific article published on 9 November 2015

Thermal Engineering in Low-Dimensional Quantum Devices: A Tutorial Review of Nonequilibrium Green's Function Methods

article

Thermal and thermoelectric properties of graphene ⬇️

scientific article published on 07 March 2014

Thermal transport along Bi2Te3 topological insulator nanowires

Thermal transport by phonons in zigzag graphene nanoribbons with structural defects

scientific article published on 19 July 2011

Thermal transport in graphene junctions and quantum dots

scholarly article in Physical Review B, vol. 81 no. 19, May 2010

Time-reversal symmetry protected chiral interface states between quantum spin and quantum anomalous Hall insulators

scholarly article in Physical Review B, vol. 92 no. 7, August 2015

Topological and electronic transitions in a Sb(111) nanofilm: The interplay between quantum confinement and surface effect

scholarly article in Physical Review B, vol. 85 no. 20, May 2012

Topological crystalline insulators in the SnTe material class.

scientific article published in January 2012

Topological insulators in transition-metal intercalated graphene: The role ofdelectrons in significantly increasing the spin-orbit gap

scholarly article in Physical Review B, vol. 87 no. 24, June 2013

Topological nodal-line semimetals in alkaline-earth stannides, germanides, and silicides ⬇️

scholarly article in Physical Review B, vol. 93 no. 20, May 2016

Topology-driven magnetic quantum phase transition in topological insulators

scientific article

Toward Single-Layer Uniform Hexagonal Boron Nitride–Graphene Patchworks with Zigzag Linking Edges

scientific article published on 14 June 2013

Transport in asymmetric multiple-barrier magnetic nanostructures

scholarly article in Physical Review B, vol. 55 no. 15, April 1997

Transverse Pressure Induced Phase Transitions in Boron Nitride Nanotube Bundles and the Lightest Boron Nitride Crystal

scientific article published on 26 March 2008

Tremendous Spin-Splitting Effects in Open Boron Nitride Nanotubes: Application to Nanoscale Spintronic Devices

scientific article published on 01 July 2006

Trends in charge transfer and spin alignment of metallocene on graphene

scholarly article in Physical Review B, vol. 83 no. 19, May 2011

Tunable Magnetism in Transition-Metal-Decorated Phosphorene

Tunable Structural, Electronic, and Optical Properties of Layered Two-Dimensional C2N and MoS2 van der Waals Heterostructure as Photovoltaic Material

Tunable anisotropic thermal conduction in graphane nanoribbons ⬇️

Tuning surface Dirac valleys by strain in topological crystalline insulators

scholarly article in Physical Review B, vol. 91 no. 19, May 2015

Tuning thermal conduction via extended defects in graphene

scholarly article in Physical Review B, vol. 87 no. 20, May 2013

Tuning thermoelectricity in a Bi2Se3topological insulator via varied film thickness

Tunneling energy barriers of emitted electrons in single-walled carbon nanotubes

scholarly article in Physical Review B, vol. 70 no. 3, July 2004

Two types of surface states in topological crystalline insulators

article by Junwei Liu et al published 11 December 2013 in Physical Review B

Type-II Ising pairing in few-layer stanene

scientific article

Ultra-stable small diameter hybrid transition metal dichalcogenide nanotubes X–M–Y (X, Y = S, Se, Te; M = Mo, W, Nb, Ta): a computational study

scientific article published on 24 July 2015

Understanding the origin of bandgap problem in transition and post-transition metal oxides

scientific article published on 01 September 2019

Uniaxial-stress effects on electronic properties of silicon carbide nanowires

scholarly article by Binghai Yan et al published 10 July 2006 in Applied Physics Letters

Universal Descriptor for Large-Scale Screening of High-Performance MXene-Based Materials for Energy Storage and Conversion

article published in 2018

Unusual vortex structure in ultrathin Pb(Zr0.5Ti0.5)O3 films

Unveiling Charge-Density Wave, Superconductivity, and Their Competitive Nature in Two-Dimensional NbSe2.

scientific article published on 13 April 2018

Weak topological insulators in PbTe/SnTe superlattices

scholarly article in Physical Review B, vol. 89 no. 8, February 2014

Weak topological insulators induced by the interlayer coupling: A first-principles study of stacked Bi2TeI

scholarly article in Physical Review B, vol. 89 no. 4, January 2014

Widely tunable band gap in a multivalley semiconductor SnSe by potassium doping

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