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List of works by Alex Zunger

2D optical photon echo spectroscopy of a self-assembled quantum dot

A polarity-induced defect mechanism for conductivity and magnetism at polar-nonpolar oxide interfaces

scientific article published on 13 October 2014

A self-interaction corrected approach to many-electron systems: Beyond the local spin density approximation

scientific article published in June 1980

Absence of intrinsic spin splitting in one-dimensional quantum wires of tetrahedral semiconductors

scholarly article in Physical Review B, vol. 84 no. 12, September 2011

Absence of redshift in the direct bandgap of silicon nanocrystals with reduced size.

scientific article published on 25 September 2017

Absence of volume metastability in bcc copper

scientific article published on 01 February 1990

Absolute deformation potentials of Al, Si, and NaCl

scientific article published on 01 December 1994

Adaptive crystal structures: CuAu and NiPt

scientific article published on 31 January 2003

Alloy-stabilized semiconducting and magnetic zinc-blende phase of MnTe

scientific article published on 01 June 1986

Altered reactivity and the emergence of ionic metal ordered structures in Li-Cs at high pressures

scientific article published on 15 June 2010

Anisotropy of interband transitions in InAs quantum wires: An atomistic theory ⬇️

scholarly article in Physical Review B, vol. 70 no. 16, October 2004

Anomalous grain boundary physics in polycrystalline CuInSe2: the existence of a hole barrier

scientific article published on 24 December 2003

Antidoping in Insulators and Semiconductors Having Intermediate Bands with Trapped Carriers

scientific article published on 01 March 2019

Assessing capability of semiconductors to split water using ionization potentials and electron affinities only

scientific article published on 01 February 2014

Atomic control of conductivity versus ferromagnetism in wide-gap oxides via selective doping: V, Nb, Ta in anatase TiO2.

scientific article

Atomic structure and ordering in semiconductor alloys

scientific article published on 01 February 1985

Atomic-scale structure of disordered Ga1-xInxP alloys

scientific article published on 01 April 1995

Band gaps and spin-orbit splitting of ordered and disordered AlxGa1-xAs and GaAsxSb1-x alloys

scientific article published on 01 February 1989

Band-gap design of quaternary (In,Ga)(As,Sb) semiconductors via the inverse-band-structure approach.

scientific article published on 5 May 2008

Band-structure, optical properties, and defect physics of the photovoltaic semiconductor SnS

Beware of plausible predictions of fantasy materials

scientific article published on 01 February 2019

Bonding charge density in GaAs

Calculation of the spin-polarized electronic structure of an interstitial iron impurity in silicon

scientific article published on 01 June 1985

Carrier multiplication in semiconductor nanocrystals: theoretical screening of candidate materials based on band-structure effects

scientific article published on 26 August 2008

Cation off-stoichiometry leads to highp-type conductivity and enhanced transparency in Co2ZnO4and Co2NiO4thin films

scholarly article in Physical Review B, vol. 85 no. 8, February 2012

Changes in charge density vs changes in formal oxidation states: The case of Sn halide perovskites and their ordered vacancy analogues

Charge self-regulation upon changing the oxidation state of transition metals in insulators

scientific article published in Nature

Chemical and elastic effects on isostructural phase diagrams: The epsilon -G approach

scientific article published on 01 June 1988

Chemical trends in band offsets of Zn- and Mn-based II-VI superlattices: d-level pinning and offset compression

scientific article published on 01 April 1996

Chemical trends in ground- and excited-state properties of interstitial 3d impurities in silicon

scientific article published on 01 June 1985

Cluster-doping approach for wide-gap semiconductors: the case of p-type ZnO

scientific article published on 24 June 2003

Comment on "Electronic structure and optical properties of Si-Ge superlattices"

scientific article published on 01 February 1989

Comment on "Intrinsic n-type behavior in transparent conducting oxides: a comparative hybrid-functional study of In2O3, SnO2, and ZnO"

scientific article published on 10 February 2011

Comment on "Origins of compositional order in NiPt alloys"

scientific article published on 01 March 1992

Common-anion rule and its limits: Photoemission studies of CuInxGa1-xSe2-Ge and CuxAg1-xInSe2-Ge interfaces

scientific article published on 01 December 1987

Comparison of predicted ferromagnetic tendencies of Mn substituting the Ga site in III–V’s and in I–III–VI2 chalcopyrite semiconductors

Comparison of two cluster-expansion methods for the energetics of Pd-V alloys

scientific article published on 01 October 1994

Composition pinning in epitaxial alloys

scientific article published on 01 December 1988

Composition-dependence of deep impurity levels in alloys

scientific article published on 01 February 1985

Confinement, surface, and chemisorption effects on the optical properties of Si quantum wires

scientific article published on 01 November 1994

Control of ferromagnetism via electron doping in In2O3:Cr

scientific article published on 07 July 2008

Cu-In Halide Perovskite Solar Absorbers

scientific article published on 21 April 2017

Density-functional theory of the correlation energy in atoms and ions: A simple analytic model and a challenge

scientific article

Design and discovery of a novel half-Heusler transparent hole conductor made of all-metallic heavy elements

scientific article

Design principles and coupling mechanisms in the 2D quantum well topological insulator HgTe/CdTe

scientific article published on 21 October 2010

Design rules to achieve high-T(C) ferromagnetism in (Ga, Mn)As alloys

scientific article published on 24 May 2007

Dielectric constants of silicon quantum dots

scientific article published on 01 August 1994

Direct calculation of the transport properties of disordered AlAs/GaAs superlattices from the electronic and phonon spectra

scientific article published on 01 January 1996

Direct carrier multiplication due to inverse Auger scattering in CdSe quantum dots

Direct-bandgap InAs quantum-dots have long-range electron-hole exchange whereas indirect gap Si dots have short-range exchange

scientific article published on 01 July 2009

Discovery of a novel linear-in-k spin splitting for holes in the 2D GaAs/AlAs system

scientific article published on 10 February 2010

Disorder effects on the density of states of the II-VI semiconductor alloys Hg0.5Cd0.5Te, Cd0.5Zn0.5Te, and Hg0.5Zn0.5Te

scientific article published on 01 January 1991

Dissecting biexciton wave functions of self-assembled quantum dots by double-quantum-coherence optical spectroscopy

scholarly article in Physical Review B, vol. 86 no. 23, December 2012

Dopability, intrinsic conductivity, and nonstoichiometry of transparent conducting oxides

scientific article published on 23 January 2007

Doping Rules and Doping Prototypes in A2BO4 Spinel Oxides

E1, E2, and E0' transitions and pressure dependence in ordered Ga0.5In0.5P

scientific article published on 01 May 1995

Effect of chemical and elastic interactions on the phase diagrams of isostructural solids

scientific article published on 01 April 1987

Effective band structure of random alloys

scientific article published on 11 June 2010

Effects of ordering on the electron effective mass and strain deformation potential in GaInP2: Deficiencies of the k

scientific article published on 01 November 1995

Efficient Inverse Auger Recombination at Threshold in CdSe Nanocrystals ⬇️

Efficient cluster expansion for substitutional systems

scientific article published on 01 November 1992

Electron Doping of Proposed Kagome Quantum Spin Liquid Produces Localized States in the Band Gap

scientific article published on 01 November 2018

Electron and hole addition energies in PbSe quantum dots

article

Electronic charge distribution in crystalline diamond, silicon, and germanium

scientific article published on 01 April 1993

Electronic charge distribution in crystalline germanium

scientific article published on 01 October 1995

Electronic correlation in anion p orbitals impedes ferromagnetism due to cation vacancies in Zn chalcogenides

scientific article published on 02 July 2009

Electronic origins of the magnetic phase transitions in zinc-blende Mn chalcogenides

scientific article published on 01 September 1993

Electronic phase diagrams of carriers in self-assembled quantum dots: violation of Hund's rule and the Aufbau principle for holes

scientific article published on 09 December 2005

Electronic properties of random alloys: Special quasirandom structures

scientific article published on 01 November 1990

Electronic structure and density of states of the random Al0.5Ga0.5As, GaAs0.5P0.5, and Ga0.5In0.5As semiconductor alloys

scientific article published on 01 October 1991

Electronic structure and phase stability of LiZnAs: A half ionic and half covalent tetrahedral semiconductor

scientific article published on 01 February 1986

Electronic structure of BAs and boride III-V alloys

scientific article

Electronic structure of LiZnN: Interstitial insertion rule

scientific article published on 01 July 1985

Electronic structure of M3ISb-type filled tetrahedral semiconductors

scientific article published on 01 March 1987

Electronic structure of ZnS, ZnSe, ZnTe, and their pseudobinary alloys

scientific article published on 01 August 1987

Electronic structure of copper, silver, and gold impurities in silicon.

scientific article published in July 1985

Electronic structure of filled tetrahedral semiconductors

scientific article published on 01 February 1985

Electronic structure of generic semiconductors: Antifluorite silicide and III-V compounds

scientific article published on 01 September 1986

Electronic structure of intentionally disordered AlAs/GaAs superlattices

scientific article published on 01 March 1995

Electronic structure of ordered and disordered Cu3Au and Cu3Pd

scientific article published on 01 May 1992

Electronic structure of random Ag0.5Pd0.5 and Ag0.5Au0.5 alloys

scientific article published on 01 November 1991

Electronic structure of random Al0.5Ga0.5As alloys: Test of the "special-quasirandom-structures" description

scientific article published on 01 August 1990

Electronic structure of semiconductor quantum films

scientific article published on 01 October 1993

Electronic structure of transition-atom impurities in GaP

scientific article published on 01 March 1985

Empirical atomic pseudopotentials for AlAs/GaAs superlattices, alloys, and nanostructures

scientific article published on 01 December 1994

Epitaxial effects on coherent phase diagrams of alloys

scientific article published on 01 September 1988

Epitaxial effects on coherent phase diagrams of alloys

scientific article published on 01 August 1989

Epitaxy-induced structural phase transformations

scientific article published on 01 November 1988

Erratum: Atomic structure and ordering in semiconductor alloys

scientific article published on 01 December 1988

Erratum: Disorder effects on the density of states of the II-VI semiconductor alloys Hg0.5Cd0.5Te, Cd0.5Zn0.5Te, and Hg0.5Zn0.5Te

scientific article published on 01 June 1991

Evolution of III-V nitride alloy electronic structure: the localized to delocalized transition

scientific article published on 01 March 2001

Evolution of alloy properties with long-range order

scientific article published on 01 December 1992

Evolution of electronic structure as a function of layer thickness in group-VIB transition metal dichalcogenides: emergence of localization prototypes

scientific article

Evolutionary approach for determining first-principles hamiltonians

scientific article published on 17 April 2005

Examining Förster Energy Transfer for Semiconductor Nanocrystalline Quantum Dot Donors and Acceptors

Exchange-correlation-induced "negative effective U"

scientific article published on 01 October 1985

Excited-state relaxation in PbSe quantum dots ⬇️

scientific article published in April 2008

Excitons and excitonic fine structures in Si nanowires: Prediction of an electronic state crossover with diameter changes

scholarly article in Physical Review B, vol. 84 no. 7, August 2011

Experimental imaging and atomistic modeling of electron and hole quasiparticle wave functions inInAs∕GaAsquantum dots

scholarly article in Physical Review B, vol. 76 no. 7, August 2007

Finding the atomic configuration with a required physical property in multi-atom structures.

scientific article published on 21 September 2007

Fine structure of negatively and positively charged excitons in semiconductor quantum dots: electron-hole asymmetry

scientific article published on 19 January 2007

First-principles calculation of alloy phase diagrams: The renormalized-interaction approach

scientific article published on 01 August 1989

First-principles calculation of semiconductor-alloy phase diagrams

scientific article published on 01 January 1987

First-principles calculation of temperature-composition phase diagrams of semiconductor alloys

scientific article published on 01 April 1990

First-principles calculation of the formation energies of ordered and disordered phases of AlAs-GaAs

scientific article published on 01 July 1989

First-principles calculation of the order-disorder transition in chalcopyrite semiconductors

scientific article published on 01 February 1992

First-principles calculations of the phase diagrams of noble metals: Cu-Au, Cu-Ag, and Ag-Au

scientific article published on 01 September 1987

First-principles combinatorial design of transition temperatures in multicomponent systems: the case of Mn in GaAs

scientific article published on 27 July 2006

First-principles determination of low-temperature order and ground states of Fe-Ni, Fe-Pd, and Fe-Pt

scholarly article in Physical Review B, vol. 80 no. 22, December 2009

First-principles phase diagrams of pseudoternary chalcopyrite-zinc-blende alloys

scientific article published on 01 April 1993

First-principles predictions of yet-unobserved ordered structures in the Ag-Pd phase diagram

scientific article published on 26 September 2001

First-principles simulated-annealing study of phase transitions and short-range order in transition-metal and semiconductor alloys

scientific article published on 01 September 1994

First-principles statistical mechanics of structural stability of intermetallic compounds

scientific article published on 01 July 1991

First-principles study of intervalley mixing: Ultrathin GaAs/GaP superlattices

scientific article published on 01 April 1991

First-principles theory of short-range order, electronic excitations, and spin polarization in Ni-V and Pd-V alloys

scientific article

Full-zone spin splitting for electrons and holes in bulk GaAs and GaSb

scientific article published on 05 February 2009

Functionality-Directed Screening of Pb-Free Hybrid Organic–Inorganic Perovskites with Desired Intrinsic Photovoltaic Functionalities

Genetic design of enhanced valley splitting towards a spin qubit in silicon

scientific article published on January 2013

Genetic-algorithm discovery of a direct-gap and optically allowed superstructure from indirect-gap Si and Ge semiconductors

scientific article published on 12 January 2012

Genomic design of strong direct-gap optical transition in Si/Ge core/multishell nanowires

scientific article published on 17 January 2012

Giant and composition-dependent optical bowing coefficient in GaAsN alloys

scientific article published on 01 January 1996

Ground-state structures and the random-state energy of the Madelung lattice

scientific article published on 01 December 1990

Highly reduced fine-structure splitting in InAs/InP quantum dots offering an efficient on-demand entangled 1.55-microm photon emitter

scientific article published on 09 October 2008

Identification of potential photovoltaic absorbers based on first-principles spectroscopic screening of materials

scientific article published on 10 February 2012

Identity of the conduction-band minimum in (AlAs)1/(GaAs)1 (001) superlattices: Intermixing-induced reversal of states

scientific article published on 01 May 1992

Impact ionization can explain carrier multiplication in PbSe quantum dots

scientific article published in October 2006

Importance of Second-Order Piezoelectric Effects in Zinc-Blende Semiconductors

scientific article

Impurity clustering and ferromagnetic interactions that are not carrier induced in dilute magnetic semiconductors: the case of Cu2O:Co

scientific article published on 18 October 2007

InAsSb/InAs: A type-I or a type-II band alignment

scientific article published on 01 October 1995

Indium-indium pair correlation and surface segregation in InGaAs alloys

scientific article published on 01 April 2000

Instilling defect tolerance in new compounds

scientific article

Intrinsic DX centers in ternary chalcopyrite semiconductors

scientific article published on 03 January 2008

Intrinsic Transparent Conductors without Doping

scientific article published on 23 October 2015

Intrinsic circular polarization in centrosymmetric stacks of transition-metal dichalcogenide compounds

scientific article published on 27 February 2015

Inverse design approach to hole doping in ternary oxides: Enhancingp-type conductivity in cobalt oxide spinels

scholarly article by J. D. Perkins et al published 14 November 2011 in Physical Review B

Ising-like description of structurally relaxed ordered and disordered alloys

scientific article published on 01 October 1995

Large lattice-relaxation-induced electronic level shifts in random Cu1-xPdx alloys

scientific article published on 01 August 1991

Li-Doped Cr2MnO4: A New p-Type Transparent Conducting Oxide by Computational Materials Design

Lifetime and polarization of the radiative decay of excitons, biexcitons, and trions in CdSe nanocrystal quantum dots ⬇️

scholarly article in Physical Review B, vol. 75 no. 11, March 2007

Local-density-derived semiempirical pseudopotentials

scientific article published on 01 June 1995

Localization and percolation in semiconductor alloys: GaAsN vs GaAsP

scientific article published on 01 December 1996

Long- versus short-range order in Ni3V and Pd3V alloys

scientific article published on 01 June 1994

Long-range order in binary late-transition-metal alloys

scientific article published on 01 April 1991

Magnetism without magnetic ions: percolation, exchange, and formation energies of magnetism-promoting intrinsic defects in CaO

scientific article published on 14 March 2006

Mapping the orbital wavefunction of the surface states in three-dimensional topological insulators

Metal-dimer atomic reconstruction leading to deep donor states of the anion vacancy in II-VI and chalcopyrite semiconductors

scientific article published on 05 October 2004

Metastable impurities in semiconductors: Si:Mg and Si:Be

scientific article published on 01 November 1986

Method of linear combination of structural motifs for surface and step energy calculations: Application to GaAs(001)

scientific article published on 01 January 1996

Microscopic origin of the phenomenological equilibrium "Doping limit Rule" in n-type III-V semiconductors

scientific article published on 01 February 2000

Mixed-basis cluster expansion for thermodynamics of bcc alloys

scholarly article in Physical Review B, vol. 70 no. 15, October 2004

Negative spin-orbit bowing in semiconductor alloys

scientific article published on 01 March 1989

New optical transitions in strained Si-Ge superlattices

scientific article published on 01 September 1987

Off-center atomic displacements in zinc-blende semiconductor

scientific article published on 01 March 1993

Optical bowing in zinc chalcogenide semiconductor alloys

scientific article published on 01 October 1986

Optical properties of zinc-blende semiconductor alloys: Effects of epitaxial strain and atomic ordering

scientific article published on 01 May 1994

Optical spectroscopy of single quantum dots at tunable positive, neutral, and negative charge states

scientific article published in September 2001

Ordered-vacancy-compound semiconductors: Pseudocubic CdIn2Se4

scientific article published on 01 April 1988

Ordering of isovalent intersemiconductor alloys

scientific article published on 01 September 1988

Ordering thermodynamics of surface and subsurface layers in the Ga1-xInxP alloy

scientific article published on 01 May 1992

Origin of band gaps in 3d perovskite oxides

scientific article published on 10 April 2019

Origin of one-photon and two-photon optical transitions in PbSe nanocrystals

scholarly article in Physical Review B, vol. 79 no. 24, June 2009

Origins of coexistence of conductivity and transparency in SnO(2)

scientific article published on 12 February 2002

Origins of nonstoichiometry and vacancy ordering in Sc1-x squarexS

scientific article published on 13 December 2001

Origins ofk·perrors for [001] GaAs/AlAs heterostructures

scientific article published on 10 February 1996

Pauli blocking versus electrostatic attenuation of optical transition intensities in chargedPbSequantum dots

scholarly article in Physical Review B, vol. 76 no. 16, October 2007

Point-charge electrostatics in disordered alloys

scientific article published on 01 September 1996

Predicting structural energies of atomic lattices

scientific article published on 01 January 1991

Prediction and Synthesis of Strain Tolerant RbCuTe Crystals Based on Rotation of One-Dimensional Nano Ribbons within a Three-Dimensional Inorganic Network

scientific article published on 27 August 2015

Prediction and accelerated laboratory discovery of previously unknown 18-electron ABX compounds

scientific article published on 01 April 2015

Prediction of a Shape-Induced Enhancement in the Hole Relaxation in Nanocrystals ⬇️

Prediction of a low-spin ground state in the GaAs:V2+ impurity system

scientific article published on 01 February 1986

Prediction of an excitonic ground state in InAs/InSb quantum dots

scientific article published on 03 January 2005

Prediction of ordered structures in the bcc binary systems of Mo, Nb, Ta, and W from first-principles search of approximately 3,000,000 possible configurations

scholarly article in Physical Review B, vol. 72 no. 2, July 2005

Prediction of unusual stable ordered structures of Au-Pd alloys via a first-principles cluster expansion

scholarly article in Physical Review B, vol. 74 no. 3, July 2006

Predictions and systematizations of the zinc-blende-wurtzite structural energies in binary octet compounds

scientific article published on 01 May 1992

Pseudopotential Theory of Auger Processes in CdSe Quantum Dots ⬇️

scientific article published in Physical Review Letters

Pseudopotential calculations of band gaps and band edges of short-period(InAs)n∕(GaSb)msuperlattices with different substrates, layer orientations, and interfacial bonds

scholarly article in Physical Review B, vol. 77 no. 11, March 2008

Pseudopotential calculations of nanoscale CdSe quantum dots

scientific article published on 01 April 1996

Pseudopotential-based multiband k

scientific article published on 01 October 1996

Publisher's Note: Prediction of ordered structures in the bcc binary systems of Mo, Nb, Ta, and W from first-principles search of approximately 3,000,000 possible configurations [Phys. Rev. B72, 020104(R) (2005)]

scholarly article in Physical Review B, vol. 72 no. 6, August 2005

Quantum-confinement-induced Gamma -->X transition in GaAs/AlGaAs quantum films, wires, and dots

scientific article published on 01 November 1995

Quasi-Direct Optical Transitions in Silicon Nanocrystals with Intensity Exceeding the Bulk

scientific article published on 22 February 2016

Rapid Transition of the Hole Rashba Effect from Strong Field Dependence to Saturation in Semiconductor Nanowires

scientific article published on 21 September 2017

Real-space description of semiconducting band gaps in substitutional systems

scientific article published on 01 October 1991

Reinterpretation of the Expected Electronic Density of States of Semiconductor Nanowires

scientific article published on 05 December 2014

Relationships between the band gaps of the zinc-blende and wurtzite modifications of semiconductors

scientific article published on 01 July 1994

Reply to "Comment on 'Atomic structure and ordering in semiconductor alloys' "

scientific article published on 01 August 1987

Role of d orbitals in valence-band offsets of common-anion semiconductors

scientific article published on 01 July 1987

Role of metal d states in II-VI semiconductors

scientific article published on 01 May 1988

Room-temperature ferromagnetism in Mn-doped semiconducting CdGeP2

scientific article published on 14 January 2002

Searching for alloy configurations with target physical properties: impurity design via a genetic algorithm inverse band structure approach.

scientific article published on 25 July 2006

Self-assembled quantum dots in a nanowire system for quantum photonics

scientific article published on 3 February 2013

Self-interaction correction to density-functional approximations for many-electron systems

scientific article

Short- and long-range order of the binary Madelung lattice

scientific article published on 01 March 1995

Short- and long-range-order effects on the electronic properties of III-V semiconductor alloys

scientific article published on 01 April 1995

Simple point-ion electrostatic model explains the cation distribution in spinel oxides

scientific article published on 10 August 2010

Sorting Stable versus Unstable Hypothetical Compounds: The Case of Multi-Functional ABX Half-Heusler Filled Tetrahedral Structures

Spatial correlations in GaInAsN alloys and their effects on band-gap enhancement and electron localization

scientific article published on 01 March 2001

Special quasirandom structures

scientific article

Spin-polarization-induced structural selectivity in Pd3X and Pt3X (X=3d) compounds

scientific article published on 01 August 1995

Spontaneous surface-induced long-range order in Ga0.5In0.5P alloys

scientific article published on 01 November 1991

Stability and band offsets of heterovalent superlattices: Si/GaP, Ge/GaAs, and Si/GaAs

scientific article published on 01 August 1990

Stability and electronic structure of ultrathin

scientific article published on 01 January 1988

Stability of bulk and pseudomorphic epitaxial semiconductors and their alloys

scientific article published on 01 February 1988

Stability of coherently strained semiconductor superlattices

scientific article published on 01 January 1990

Stability of ordered bulk and epitaxial semiconductor alloys

scientific article published on 01 March 1986

Strain energy and stability of Si-Ge compounds, alloys, and superlattices

scientific article published on 01 July 1991

Strain-minimizing tetrahedral networks of semiconductor alloys

scientific article published on 01 October 2007

Strong Absorption Enhancement in Si Nanorods.

scientific article published on 21 November 2016

Structural and chemical changes in binary versus ternary tetrahedral semiconductors

scientific article published on 01 August 1985

Structural and electronic properties of epitaxial thin-layer SinGen superlattices

scientific article published on 01 April 1988

Structural complexity in binary bcc ground states: The case of bcc Mo-Ta

scholarly article in Physical Review B, vol. 69 no. 2, January 2004

Structural phase transition in (GaAs)1-xGe2x and (GaP)1-xSi2x alloys: Test of the bulk thermodynamic description

scientific article published on 01 June 1991

Structural stability of crystalline compounds

scientific article published on 01 July 1985

Structure of the As Vacancies on GaAs(110) Surfaces

scientific article published on 01 July 1996

Structure prediction and targeted synthesis: a new Na(n)N2 diazenide crystalline structure

scientific article published on 01 November 2010

Successes and failures of the k

scientific article published on 01 March 1996

Surface Origin of High Conductivities in UndopedIn2O3Thin Films

scientific article published in Physical Review Letters

Surface segregation and ordering in III-V semiconductor alloys

scientific article published on 01 February 1996

Surface-induced ordering in GaInP

scientific article published on 01 April 1991

Switching a normal insulator into a topological insulator via electric field with application to phosphorene

scientific article published on 26 January 2015

Temperature dependence of excitonic radiative decay in CdSe quantum dots: the role of surface hole traps

scientific article published in December 2005

The Peculiar Electronic Structure of PbSe Quantum Dots

The inverse band-structure problem of finding an atomic configuration with given electronic properties

scientific article published in Nature

Theoretical prediction and experimental realization of new stable inorganic materials using the inverse design approach

scientific article

Theory of excitonic spectra and entanglement engineering in dot molecules.

scientific article published on 22 July 2004

Theory of interfacial stability of semiconductor superlattices

scientific article published on 01 June 1992

Theory of reflectance-difference spectroscopy in ordered III-V semiconductor alloys

scientific article published on 01 May 1995

Thermodynamic instability of ordered (001) AlGaAs2 in bulk form

scientific article published on 01 January 1991

Thermodynamic instability of ultrathin semiconductor superlattices: The (001) (GaAs)1(AlAs)1 structure

scientific article published on 01 March 1987

Thermodynamic stability of (AlAs)n(GaAs)n superlattices and the random Al0.5Ga0.5As alloy

scientific article published on 01 September 1988

Thermodynamic theory of epitaxial alloys: first-principles mixed-basis cluster expansion of (In, Ga)N alloy film

scientific article published on 29 June 2009

Topological Insulators versus Topological Dirac Semimetals in Honeycomb Compounds

scientific article published on 15 October 2018

Total-energy and band-structure calculations for the semimagnetic Cd1-xMnxTe semiconductor alloy and its binary constituents

scientific article published on 01 February 1987

Two-dimensional polaronic behavior in the binary oxides m-HfO2 and m-ZrO2

scientific article published on 14 March 2012

Type-II-->type-I transition in (GaX)n/(InX)n (001) superlattices (X=P, Sb) as a function of period n

scientific article published on 01 September 1994

Uncovering and tailoring hidden Rashba spin-orbit splitting in centrosymmetric crystals

scientific article published on 22 February 2019

Unequal wave vectors in short- versus long-range ordering in intermetallic compounds

scientific article published on 01 September 1994

Universal electrostatic origin of cation ordering in A2BO4 spinel oxides

scientific article published on 12 July 2011

Unusual directional dependence of exchange energies in GaAs diluted with Mn: is the RKKY description relevant?

scientific article

Using design principles to systematically plan the synthesis of hole-conducting transparent oxides: Cu3VO4and Ag3VO4as a case study

scholarly article in Physical Review B, vol. 84 no. 16, October 2011

Using genetic algorithms to map first-principles results to model Hamiltonians: Application to the generalized Ising model for alloys

article

Using superlattice ordering to reduce the band gap of random (In,Ga)As/InP alloys to a target value via the inverse band structure approach

scholarly article in Physical Review B, vol. 78 no. 16, October 2008

Why can CuInSe2 be readily equilibrium-doped n-type but the wider-gap CuGaSe2 cannot?

Wide InP Nanowires with Wurtzite/Zincblende Superlattice Segments Are Type-II whereas Narrower Nanowires Become Type-I: An Atomistic Pseudopotential Calculation

scientific article published on 13 October 2010

Zinc-blende-wurtzite polytypism in semiconductors

scientific article published on 01 October 1992

d-band excitations in II-VI semiconductors: A broken-symmetry approach to the core hole

scientific article published on 01 November 1995

n-type doping of oxides by hydrogen

scientific article

n-type doping principles for doping CuInSe/sub 2/ and CuGaSe/sub 2/ with Cl, Br, I, Mg, Zn, and Cd

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