W. Lambrecht

发表

Strain effects on the spin-orbit-induced band structure splittings in monolayer MoS2and graphene

H. Dery, T. Cheiwchanchamnangij, W. Lambrecht, 2013, 1308.2733.

Quasiparticle band structure calculation of monolayer, bilayer, and bulk MoS 2

Walter R. L. Lambrecht, T. Cheiwchanchamnangij, W. Lambrecht, 2012 .

Spin-polarized two-dimensional electron/hole gases on LiCoO$_2$ layers.

Santosh Kumar Radha, W. Lambrecht, S. Radha, 2020, SciPost Physics.

Critical evaluation of the LDA + U approach for band gap corrections in point defect calculations: The oxygen vacancy in ZnO case study

Adisak Boonchun, Walter R. L. Lambrecht, W. Lambrecht, 2011 .

Stacking fault band structure in 4H–SiC and its impact on electronic devices

M. Miao, S. Limpijumnong, W. Lambrecht, 2001 .

Structure and phonons ofZnGeN2

Kwiseon Kim, E. Alldredge, W. Lambrecht, 2005 .

Candidates for p-type doping of ZnGeN2

W. Lambrecht, D. Skachkov, 2020 .

First-principles calculations of phonons and Raman and infrared spectra in Cd-IV-N2compounds

W. Lambrecht, S. Lyu, 2018, Journal of Applied Physics.

Raman study of the vibrational modes in ZnGeN2 (0001)

J. Shan, K. He, W. Lambrecht, 2016, 1609.09535.

Valence-band discontinuity between GaN and AlN measured by x-ray photoemission spectroscopy

Hadis Morkoç, Ankur Agarwal, Walter R. L. Lambrecht, 1994 .

Role of the different defects, their population and distribution in the LaAlO3/SrTiO3 heterostructure's behavior

M. Walls, A. Sehirlioglu, P. Berger, 2018 .

Atomic-resolved depth profile of strain and cation intermixing around LaAlO3/SrTiO3 interfaces

M. Walls, A. Sehirlioglu, P. Berger, 2016, Scientific Reports.

Heteroepitaxy of diamond on c-BN: Growth mechanisms and defect characterization

A. Argoitia, J. Angus, P. Pirouz, 1994 .

Gadolinium and Oxygen co-doping of Gallium Nitride: an LSDA + U study

P. Larson, W. Lambrecht, 2006 .

SECOND-HARMONIC GENERATION AND BIREFRINGENCE OF SOME TERNARY PNICTIDE SEMICONDUCTORS

S. Limpijumnong, W. Lambrecht, Sergey N.Rashkeev, 1998, cond-mat/9809378.

Theoretical study of cation-related point defects in ZnGeP2

M. Miao, W. Lambrecht, Xiaoshu Jiang, 2005 .

Theoretical study of the phosphorus vacancy in Zn Ge P 2

M. Miao, W. Lambrecht, Xiaoshu Jiang, 2006 .

Core Hole Relaxation Energy in Semiconductors. Using a Pseudopotcntial Description of the Core Hole Perturbation

N. Castellani, W. Lambrecht, 1989 .

First principles calculations of elastic properties under pressure in SiC

S. Limpijumnong, W. Lambrecht, Kanoknan Sarasamak, 2010 .

High field electron transport properties of bulk ZnO

K. Brennan, P. Ruden, J. Albrecht, 1999 .

Quasiparticle self-consistent $GW$ band structures and phase transitions of LiAlO$_2$ in tetrahedrally and octahedrally coordinated structures

W. Lambrecht, Phillip Popp, 2022, 2205.08638.

Charge-neutral disorder and polytypes in heterovalent wurtzite-based ternary semiconductors: The importance of the octet rule

Grant T. Junno, J. Shan, Lu Han, 2015 .

Quasiparticle self-consistent GW band structure of CrN

T. Cheiwchanchamnangij, W. Lambrecht, 2020, Physical Review B.

Disorder effects on the band structure of ZnGeN 2 : Role of exchange defects

Dmitry Skachkov, W. Lambrecht, P. Quayle, 2016 .

Magnetic exchange interactions in the gadolinium pnictides from first principles

W. Lambrecht, C. Mitra, 2008 .

Electronic structure and total energy of diamond/BeO interfaces

B. Segall, W. Lambrecht, 1992 .

Electronic Structure of Wide Bandgap Semiconductor Interfaces: Cubic SiC/AIN, SiC/BP, C/BN

B. Segall, W. Lambrecht, 1989 .

Electronic band structure trends of perovskite halides: Beyond Pb and Sn to Ge and Si

W. Lambrecht, Ling-yi Huang, Ling-Yi Huang, 2016 .

Band Gaps and Stability of CsSiX3 Halides

Santosh Kumar Radha, W. Lambrecht, 2019, physica status solidi (a).

Optoelectronic Dichotomy of Mixed Halide CH3NH3Pb(Br1- xCl x)3 Single Crystals: Surface versus Bulk Photoluminescence.

Yixin Zhao, C. Burda, Taiyang Zhang, 2018, Journal of the American Chemical Society.

Understanding the Crystallographic Phase Relations in Alkali‐Trihalogeno‐Germanates in Terms of Ferroelectric or Antiferroelectric Arrangements of the Tetrahedral GeX3 Units

Santosh Kumar Radha, W. Lambrecht, 2019, Advanced Electronic Materials.

Valence-band ordering and magneto-optic exciton fine structure in ZnO

B. Meyer, A. Rodina, S. Limpijumnong, 2002 .

Second-harmonic generation of I-III-VI 2 chalcopyrite semiconductors: Effects of chemical substitutions

S. Rashkeev, W. Lambrecht, 2001 .

Vibrational spectra and nonlinear optical coefficients of rhombohedral CsGe X 3 halide compounds with X = I , Br, Cl

W. Lambrecht, Ling-yi Huang, 2016 .

Band-Offsets Between Group-III-Nitrides

B. Segall, W. Lambrecht, E. Albanesi, 1994 .

Ion blocking dip shape analysis around a LaAlO 3 /SrTiO 3 interface

A. Sehirlioglu, W. Lambrecht, D. Jalabert, 2018 .

Elastic Constants and Related Properties of the Group III-Nitrides

Kwiseon Kim, B. Segall, W. Lambrecht, 1995 .

Nanometer-scale investigation of metal-SiC interfaces using ballistic electron emission microscopy

W. J. Choyke, B. Kaczer, S. Limpijumnong, 1998 .

Experimental determination of the valence band offsets of ZnGeN2 and (ZnGe)0.94Ga0.12N2 with GaN

Hongping Zhao, L. Brillson, Jinwoo Hwang, 2021, 2102.02389.

Electronic Structure of Wide-Band-Gap Chalcopyrites

A. Petukhov, B. Segall, W. Lambrecht, 1992 .

Core‐Hole Screening in Small Metallic Particles as a Function of Core‐Hole Position

N. Castellani, W. Lambrecht, D. Leroy, 1985 .

Theoretical study of the relative stability of wurtzite and rocksalt phases in MgO and GaN

S. Limpijumnong, W. Lambrecht, 2001 .

Quasiparticle self-consistent GW band structures and phase transitions of LiAlO2

W. Lambrecht, Phillip Popp, 2022, Physical Review Materials.

Quaternary MgSiN_2-GaN alloy semiconductors for deep UV applications

W. Lambrecht, Ozan Dernek, 2022, 2208.00908.

Quasiparticle self-consistent GW band structures and phase transitions of LiAlO2

W. Lambrecht, Phillip Popp, 2022, Physical Review Materials.

Topological quantum switch and controllable one-dimensional conducting paths in antimonene facilitated by breaking the inversion symmetry

Santosh Kumar Radha, W. Lambrecht, 2020 .

Buckled honeycomb antimony: Higher order topological insulator and its relation to the Kekulé lattice

Santosh Kumar Radha, W. Lambrecht, 2020 .

Computational study of electron paramagnetic resonance parameters for Mg and Zn impurities in β-Ga2O3

W. Lambrecht, D. Skachkov, 2019, Applied Physics Letters.

Structural studies and electronic properties of diamond-like amorphous carbon

C. H. Lee, W. Lambrecht, P. Kelires, 1993 .

Electronic Structure of Diamond, Silicon Carbide, and the Group-III Nitrides

W. Lambrecht, 1994 .

Ferromagnetic redshift of the optical gap in GdN

H. Trodahl, W. Lambrecht, B. Ruck, 2007, 0705.2912.

From Band Structures to Linear and Nonlinear Optical Spectra in Semiconductors

S. Rashkeev, W. Lambrecht, 2000 .

Calculated electron paramagnetic resonance g tensor and hyperfine parameters for zinc vacancy and N related defects in ZnO

W. Lambrecht, Adisak Boonchun, Klichchupong Dabsamut, 2022, Physical Review Materials.

Delocalization of dark and bright excitons in flat-band materials and the optical properties of V2O5

L. Reining, A. Schleife, M. Feneberg, 2022, npj Computational Materials.

Noncritically phase-matched second-harmonic-generation chalcopyrites based onCdSiAs2andCdSiP2

W. Lambrecht, Xiaoshu Jiang, 2004 .

Lattice dynamics in perovskite halides CsSnX$_3$ with X=I,Br,Cl

W. Lambrecht, Ling-yi Huang, Ling-Yi Huang, 2014 .

Quasiparticle self-consistent G W calculations of the electronic band structure of bulk and monolayer V 2 O 5

M. Schilfgaarde, W. Lambrecht, Churna Bhandari, 2015 .

Graphitization Effects on Diamond Surfaces and the Diamond/Graphite Interface

J. Angus, T. Frauenheim, M. Heggie, 1996 .

Electronic structure of CrN: A borderline Mott insulator

W. Lambrecht, Aditi Herwadkar, 2009 .

Investigation of the stability of the hexagonal–cubic born nitride prism interface

T. Frauenheim, W. Lambrecht, Jörg Widany, 1996 .

Electronic Band Structure of SiC Polytypes: A Discussion of Theory and Experiment

S. Rashkeev, S. Limpijumnong, B. Segall, 1997 .

Single crystal V2O5 and lower oxides. A survey of their electronic, optical, structural, and surface properties

L. Fiermans, J. Vennik, W. Lambrecht, 1980 .

Band structure parameters of wurtzite and zinc-blende GaAs under strain in the GW approximation

T. Cheiwchanchamnangij, W. Lambrecht, 2011 .

Electronic structure of 3C inclusions in 4H SiC

M. Miao, W. Lambrecht, 2007 .

Electronic driving force for stacking fault expansion in4H‐SiC

M. Miao, W. Lambrecht, 2006 .

Electronic and optical properties of the group-III nitrides, their heterostructures and alloys

Kwiseon Kim, S. Rashkeev, B. Segall, 1995 .

Valence band structure of polytypic zinc-blende/wurtzite GaAs nanowires probed by polarization-dependent photoluminescence

G. Abstreiter, A. F. Morral, A. Efros, 2012 .

Calculated phonon band structure and density of states and interpretation of the Raman spectrum in rocksalt ScN

W. Lambrecht, T. Paudel, 2009 .

Band structure ofCdGeAs2near the fundamental gap

S. Limpijumnong, W. Lambrecht, 2002 .

GaAs Nanowires: A New Place to Explore Polytype Physics

A. Efros, W. Lambrecht, Tawainan Cheiwchanchamnangij, 2012 .

The influence of hydrogen saturation on the local densities of states in small Si, Ge AND GaAs clusters

R. Hoogewijs, J. Vennik, G. D. Meyer, 1981 .

Electronic Structure and Related Properties of Tetrahedrally Bonded Wide-Band-Gap Materials Containing Early Elements of the Periodic Table

A. Petukhov, Kwiseon Kim, C. H. Lee, 1995 .

A Comparison of the Wurtzite and Zincblende Band Structures for SiC, AlN and GaN

B. Segall, W. Lambrecht, 1992 .

Electronic structure of EuN: Growth, spectroscopy, and theory

M. Schilfgaarde, B. Cowie, N. Plank, 2011 .

The effects of biaxial strain on stability and half-metallicity of zinc blende CrSb

M. Miao, W. Lambrecht, 2005 .

Rare-earth mononitrides

N. Plank, H. Trodahl, W. Lambrecht, 2012, 1208.2410.

Chapter 12 Band Structure of the Group III Nitrides

W. Lambrecht, 1997 .

Proton irradiation induced defects in β-Ga2O3: A combined EPR and theory study

U. Gerstmann, Shengqiang Zhou, W. Lambrecht, 2018, APL Materials.

The importance of the self-interaction correction for Jahn–Teller distortion of the zinc vacancy in ZnGeP2

W. Lambrecht, Xiaoshu Jiang, 2009 .

Jahn–Teller Distortion of the Zinc Vacancy in ZnGeP2

W. Lambrecht, Jiang Xiao-shu, 2008 .

Electronic Structure of Native Point Defects in Zngep 2

M. Miao, W. Lambrecht, Xiaoshu Jiang, 2003 .

First-principles study of native defects inCdGeAs2

W. Lambrecht, T. Paudel, 2008 .

Computational identification of Ga-vacancy related electron paramagnetic resonance centers in β-Ga2O3

U. Gerstmann, W. Lambrecht, D. Skachkov, 2018, Journal of Applied Physics.

Electronic structure of bulk and surface vanadyl oxygen vacancies in the layer compound V2O5

B. Djafari-Rouhani, J. Vennik, W. Lambrecht, 1983 .

The energy band structure of V2O5. I. Theoretical approach and band calculations

B. Djafari-Rouhani, M. Lannoo, J. Vennik, 1980 .

The energy band structure of V2O5. II. Analysis of the theoretical results and comparison with experimental data

B. Djafari-Rouhani, M. Lannoo, L. Fiermans, 1980 .

Questaal: A package of electronic structure methods based on the linear muffin-tin orbital technique

Walter R. L. Lambrecht, Kirill D. Belashchenko, Dimitar Pashov, 2019, Comput. Phys. Commun..

First-principles study of the elasticity, piezoelectricity, and vibrational modes in LiGaO 2 compared with ZnO and GaN

W. Lambrecht, Adisak Boonchun, 2010 .

Theoretical evaluation of LiGaO 2 for frequency upconversion to ultraviolet

S. Rashkeev, S. Limpijumnong, W. Lambrecht, 1999 .

Band Gaps, Band‐Offsets, Disorder, Stability Region, and Point Defects in II‐IV‐N2 Semiconductors

Dmitry Skachkov, W. Lambrecht, K. Kash, 2019, physica status solidi (a).

Electronic band structure of Mg − IV − N 2 compounds in the quasiparticle-self-consistent G W approximation

W. Lambrecht, A. P. Jaroenjittichai, 2016 .

Electronic structure and magnetic properties ofMn3GaNprecipitates inGa1−xMnxN

M. Miao, W. Lambrecht, Aditi Herwadkar, 2005 .

Ultrathin 2D-oxides: A perspective on fabrication, structure, defect, transport, electron, and phonon properties

Santosh Kumar Radha, A. Sehirlioglu, Xuan P. A. Gao, 2021, Journal of Applied Physics.

X-ray absorption, glancing-angle reflectivity, and theoretical study of the N K- and Ga M{sub 2,3}-edge spectra in GaN

E. Gullikson, D. Wickenden, S. Rashkeev, 1997 .

Total energy differences between SiC polytypes revisited

S. Limpijumnong, W. Lambrecht, 1997, cond-mat/9709191.

Electronic structure of Gd pnictides calculated within the LSDA + U approach

P. Larson, W. Lambrecht, 2006 .

Electronic structure of rare-earth nitrides using the LSDA+U approach: Importance of allowing 4f orbitals to break the cubic crystal symmetry

Walter R. L. Lambrecht, Paul Larson, Mark van Schilfgaarde, 2007 .

Electronic structure and optical spectra of the semimetal ScAs and of the indirect-band-gap semiconductors ScN and GdN

W. Lambrecht, 2000 .

Diamond nucleation by hydrogenation of the edges of graphitic precursors

J. Angus, B. Segall, M. Sunkara, 1993, Nature.

Valence band effective-mass Hamiltonians for the group-III nitrides from quasiparticle self-consistentGWband structures

W. Lambrecht, Atchara Punya, 2012 .

Effective masses and valence-band splittings in GaN and AlN

Kwiseon Kim, M. Schilfgaarde, B. Segall, 1997 .

Which electronic structure method for the study of defects: A commentary

W. Lambrecht, 2011 .

Electronic structure of copper/diamond interfaces including effects of interfacial hydrogen

W. Lambrecht, 1993 .

Tight-binding muffin-tin orbital green's function method for surface and interface electronic structure calculations

W. Lambrecht, O. Andersen, 1986 .

Electronic structure of SiCTiC interfaces

B. Segall, W. Lambrecht, Benjamin Segall, 1992 .

Electronic structure, Schottky barrier, and optical spectra of the SiC/TiC {111} interface

S. Rashkeev, B. Segall, W. Lambrecht, 1997 .

First-principles study of point defects in LiGaO2

W. Lambrecht, Adisak Boonchun, Klichchupong Dabsamut, 2019, Journal of Applied Physics.

Electronic structure and magnetism of europium chalcogenides in comparison with gadolinium nitride

P. Larson, W. Lambrecht, 2006 .

Electronic band structure of ordered vacancy defect chalcopyrite compounds with formula II-III 2 -VI 4

W. Lambrecht, Xiaoshu Jiang, 2004 .

Theoretical Studies of ZnO and Related Mg x Zn1−xO Alloy Band Structures

S. Limpijumnong, B. Segall, W. Lambrecht, 1999 .

Theoretical Studies of ZnO and Related Mg x Zn 1-x O Alloy Band Structures

S. Limpijumnong, W. Lambrecht, Benjamin Segall, 1998 .

Aspects of spin-polarized scanning tunneling microscopy at the atomic scale: experiment, theory, and simulation

A. Dick, A. Smith, J. Neugebauer, 2004 .

Atomic-scale structure of η-phase Mn3N2(010) studied by scanning tunneling microscopy and first-principles theory

A. Smith, Haiqiang Yang, W. Lambrecht, 2004 .

Recent advances in atomic‐scale spin‐polarized scanning tunneling microscopy

A. Dick, A. Smith, J. Neugebauer, 2005, Microscopy research and technique.

Electronic structure and magnetic interactions in MnN and Mn3N2

M. Miao, W. Lambrecht, M. Prikhodko, 2003 .

Silicon valence band auger spectrum : A cluster approach

R. Hoogewijs, J. Vennik, G. D. Meyer, 1980 .

Erratum: Elastic constants and related properties of tetrahedrally bonded BN, AlN, GaN, and InN [Phys. Rev. B 53, 16310 (1996)]

Kwiseon Kim, B. Segall, W. Lambrecht, 1997 .

Stability and half-metallicity of transition metal pnictides in tetrahedrally bonded structures

M. Miao, W. Lambrecht, 2005 .

Electronic structure of magnetic impurities and defects in semiconductors: A guide to the theoretical models

W. Lambrecht, 2016 .

Comparison between experiment and calculated band structures for DyN and SmN

H. Trodahl, A. Bittar, Y. Zhang, 2007, cond-mat/0703740.

Carrier-controlled anomalous Hall effect in an intrinsic ferromagnetic semiconductor

H. Trodahl, W. Lambrecht, B. Ruck, 2017 .

First-principles Study of Nitrogen Vacancies in GdN

T. Cheiwchanchamnangij, W. Lambrecht, Atchara Punya, 2011 .

Electronic band structure information of GdN extracted from x-ray absorption and emission spectroscopy

L. Piper, H. Trodahl, J. Downes, 2010 .

Interstitial-nitrogen- and oxygen-induced magnetism in Gd-doped GaN

W. Lambrecht, C. Mitra, 2009 .

On the relation between XPS and AES relaxation energies in metals

N. Castellani, W. Lambrecht, D. Leroy, 1987 .

On the calculation of XPS and aes relaxation energies in density functional theory

N. Castellani, W. Lambrecht, D. Leroy, 1985 .

Atomic-scale spin-polarized scanning tunneling microscopy applied to Mn3N2(010).

A. Smith, Haiqiang Yang, W. Lambrecht, 2002, Physical review letters.

Calculated interband optical transition spectra of GdN

W. Lambrecht, C. Mitra, 2008 .

Vibrational properties of rare-earth nitrides: Raman spectra and theory

H. Trodahl, W. Lambrecht, C. Meyer, 2009 .

Electronic band structure, phonons, and exciton binding energies of halide perovskites CsSnCl 3 , CsSnBr 3 , and CsSnI 3

Ling-yi Huang, Walter R. L. Lambrecht, W. Lambrecht, 2013 .

Strong enhancement of second-order response coefficients in tellurium containing Ag-III-VI2 compounds

S. Rashkeev, W. Lambrecht, 2000 .

Computational study of phonon modes in short-period AlN/GaN superlattices

W. Lambrecht, T. Paudel, 2009 .

Electronic and crystal structure of Cu2-xS: Full-potential electronic structure calculations

T. Kotani, M. Schilfgaarde, W. Lambrecht, 2007 .

Electronic structure and magnetism in Bi 2 Te 3 , Bi 2 Se 3 , and Sb 2 Te 3 doped with transition metals (Ti–Zn)

P. Larson, W. Lambrecht, 2008 .

Electronic band structure of graphene from resonant soft x-ray spectroscopy: The role of core-hole effects

Yi Luo, Jinghua Guo, L. Piper, 2012 .

Electronic Structure of Tunable Materials MnAl and MnGa

A. Petukhov, D. Demchenko, A. Chantis, 1999 .

First-principles study of the preference for zinc-blende or rocksalt structures in FeN and CoN

W. Lambrecht, P. Lukashev, 2004 .

V2O5: A 2D van der Waals Oxide with Strong In-Plane Electrical and Optical Anisotropy.

A. Gross, H. Poelman, Xuan P. A. Gao, 2017, ACS applied materials & interfaces.

Changes of the geometry and band structure of SiC along the orthorhombic high-pressure transition path between the zinc-blende and rocksalt structures

Walter R. L. Lambrecht, Maosheng Miao, M. Miao, 2002 .

Comment on "Theory of Incomplete Crystals and Crystalline Interfaces" by F. Garcia-Moliner and V. R. Velasco

W. Lambrecht, 1987 .

Efficient ab initio method for the calculation of frequency-dependent second-order optical response in semiconductors

Walter R. L. Lambrecht, Sergey N. Rashkeev, S. Rashkeev, 1998 .

Anisotropy of UV-reflectivity in wurtzite crystals: a comparison between GaN and CdSe

W. Lambrecht, M. Prikhodko, 2002 .

Electronic structure and magnetic properties of transition-metal-doped 3C and 4H silicon carbide

M. Miao, W. Lambrecht, 2006 .

Magnetic properties of substitutional 3d transition metal impurities in silicon carbide

M. Miao, W. Lambrecht, 2003 .

Electronic structure of ZnGeP 2 : A detailed study of the band structure near the fundamental gap and its associated parameters

S. Limpijumnong, B. Segall, W. Lambrecht, 1999 .

SECOND-HARMONIC GENERATION IN SIC POLYTYPES

S. Rashkeev, B. Segall, W. Lambrecht, 1997, cond-mat/9709319.

Instability of the layered orthorhombic post-perovskite phase of SrTiO3 and other candidate orthorhombic phases under pressure

W. Lambrecht, Churna Bhandari, 2018, 1801.05901.

Improved quasiparticle self-consistent electronic band structure and excitons in β−LiGaO2

M. van Schilfgaarde, W. Lambrecht, D. Pashov, 2023, Physical Review B.

Computational study of defect complexes in $\beta$-LiGaO$_2$ and their relation to the donor-acceptor-pair recombination

W. Lambrecht, Adisak Boonchun, Klichchupong Dabsamut, 2023, 2302.09206.

Improved quasiparticle self-consistent electronic band structure and excitons in $\beta$-LiGaO$_2$

M. Schilfgaarde, W. Lambrecht, D. Pashov, 2023, 2302.03150.

Unified path for high-pressure transitions of SiC polytypes to the rocksalt structure

Walter R. L. Lambrecht, Maosheng Miao, M. Miao, 2003 .

Electronic and lattice dynamical properties of II-IV-N2 semiconductors

Walter R. L. Lambrecht, W. Lambrecht, T. Paudel, 2011 .

Optical response and band structure of LiCoO2 including electron-hole interaction effects

Santosh Kumar Radha, M. Grüning, M. van Schilfgaarde, 2021, Physical Review B.

Tight-binding approach to Computational Materials Science

Walter R. L. Lambrecht, Mark Van Schilfgaarde, M. Schilfgaarde, 1998 .

Pressure-dependent elastic constants and sound velocities of wurtzite SiC, GaN, InN, ZnO, and CdSe, and their relation to the high-pressure phase transition: A first-principles study

S. Limpijumnong, W. Lambrecht, Kanoknan Sarasamak, 2010 .

Structure and magnetic properties of MnN, CrN, and VN under volume expansion

M. Miao, W. Lambrecht, 2005 .

Electronic structure of defects and doping in ZnO: Oxygen vacancy and nitrogen doping

W. Lambrecht, Adisak Boonchun, 2013 .

Corrigendum: Quasiparticle self-consistent GW electronic band structures of Be-IV-N2 compounds (2019 J. Phys.: Condens. Matter 31 335501)

W. Lambrecht, S. Lyu, 2019, Journal of Physics: Condensed Matter.

Quasiparticle self-consistent GW electronic band structures of Be-IV-N2 compounds

W. Lambrecht, S. Lyu, 2017, Journal of physics. Condensed matter : an Institute of Physics journal.

Core-level binding energy shifts as a tool to study surface processes on LaAlO 3 /SrTiO 3

A. Voevodin, A. Sehirlioglu, S. Limpijumnong, 2017 .

Quasiparticle self-consistent GW band structure of β-Ga2O3 and the anisotropy of the absorption onset

W. Lambrecht, Amol Ratnaparkhe, 2017 .

Molecular-dynamics study of diamond/silicon (001) interfaces with and without graphitic interface layers

T. Frauenheim, W. Lambrecht, M. Sternberg, 1997 .

Electronic and magnetic properties of electron-doped V 2 O 5 and NaV 2 O 5

W. Lambrecht, Churna Bhandari, 2015 .

Systematic study of the exchange interactions in Gd-doped GaN containing N interstitials, O interstitials, or Ga vacancies

S. Blügel, P. Dederichs, R. Zeller, 2015 .

Diamond {111} Surface: Graphitization or Reconstruction?

T. Frauenheim, D. Porezag, G. Jungnickel, 1995 .

Quasiparticle Self‐Consistent GW Study of (Ga1−xAlx)2O3 Alloys in Monoclinic and Corundum Structures

W. Lambrecht, Amol Ratnaparkhe, 2019, physica status solidi (b).

Electronic structure of the vanadyl oxygen vacancy in V2O5 : periodic vacancy single layer model

B. Djafari-Rouhani, J. Vennik, W. Lambrecht, 1981 .

Theoretical study of the vanadyl-oxygen vacancy in V2O5: tight-binding Green function calculation, optical properties and neutral vacancy ground-state splitting

B. Djafari-Rouhani, J. Vennik, W. Lambrecht, 1986 .

First-principles calculation of the O vacancy in ZnO: A self-consistent gap-corrected approach

W. Lambrecht, T. Paudel, 2008 .

Nitrogen pair − hydrogen complexes in ZnO and p-type doping.

S. Limpijumnong, W. Lambrecht, Adisak Boonchun, 2012 .

All-electron quasi-particle self-consistent $GW$ band structures for SrTiO$_3$ including lattice polarization corrections in different phase

Walter R. L. Lambrecht, Mark van Schilfgaarde, T. Kotani, 2017, 1709.09194.

Electronic Structure and Magnetic Properties of Transition Metal Doped Silicon Carbide

M. Miao, W. Lambrecht, 2001 .

Effects of vacancies and impurities on the relative stability of rocksalt and zincblende structures for MnN

M. Miao, W. Lambrecht, 2007 .

Calculated phonon modes, infrared and Raman spectra in orthorhombic α − MoO3 and monolayer MoO3

W. Lambrecht, Amol Ratnaparkhe, Santosh Kumar Radha, 2021, Journal of Applied Physics.

Quasiparticle band structure of Zn-IV-N-2 compounds

M. Schilfgaarde, W. Lambrecht, Atchara Punya, 2011 .

First-principles study of phonons and related ground-state properties and spectra inZn-IV-N2compounds

W. Lambrecht, T. Paudel, 2008 .

Deep level defects and cation sublattice disorder in ZnGeN2

Hongping Zhao, L. Brillson, Jinwoo Hwang, 2020 .

Topological band structure transitions and goniopolar transport in honeycomb antimonene as a function of buckling

Santosh Kumar Radha, W. Lambrecht, 2019, 1912.03755.

Quasiparticle self-consistent GW energy band calculations for Ge3N4 phases

W. Lambrecht, Benthara Hewage Dinushi Jayatunga, 2020 .

First-principles calculations of second-order nonlinear optical coefficients in the static limit and Pockels coefficients in III-N and II−IV−N2 compounds

W. Lambrecht, S. Lyu, 2018, Physical Review Materials.

Erratum: Band offsets between ZnGeN2 , GaN, ZnO, and ZnSnN2 and their potential impact for solar cells [Phys. Rev. B 88 , 075302 (2013)]

W. Lambrecht, S. Lyu, A. P. Jaroenjittichai, 2017 .

Native interstitial defects in ZnGeN$_2$

W. Lambrecht, D. Skachkov, 2017, 1708.03589.

Native point defects and doping in ZnGeN 2

Dmitry Skachkov, W. Lambrecht, A. P. Jaroenjittichai, 2016 .

Heterovalent ternary II-IV-N2 compounds: perspectives for a new class of wide-band-gap nitrides

W. Lambrecht, Atchara Punya, 2013 .

OPTICAL-ABSORPTION BANDS IN THE 1-3 EV RANGE IN N-TYPE SIC POLYTYPES

S. Rashkeev, S. Limpijumnong, B. Segall, 1999 .

Universal transition state for high-pressure zinc blende to rocksalt phase transitions.

M. Miao, W. Lambrecht, Maosheng Miao, 2005, Physical review letters.

Core-electron relaxation energy in small metallic particles

N. Castellani, W. Lambrecht, D. Leroy, 1985 .

Magnetic properties of transition-metal nitrides

M. Miao, W. Lambrecht, P. Lukashev, 2005 .

Elastic constants and related properties of tetrahedrally bonded BN, AlN, GaN, and InN.

Kim, Kwiseon Kim, B. Segall, 1996, Physical review. B, Condensed matter.

Electronic structure of thin heterocrystalline superlattices in SiC and AlN

M. Miao, W. Lambrecht, 2003 .

Optical reflectivity of 3C and 4H‐SiC polytypes: Theory and experiment

W. J. Choyke, W. Suttrop, M. Alouani, 1993 .

Metal–Organic Chemical Vapor Deposition of ZnGeGa2N4

Hongping Zhao, W. Lambrecht, K. Kash, 2020 .

Quaternary MgSiN2 -GaN alloy semiconductors for deep UV applications

W. Lambrecht, Ozan Dernek, 2022, Physical review B.

Quaternary MgSiN_2-GaN alloy semiconductors for deep UV applications

W. Lambrecht, Ozan Dernek, 2022, 2208.00908.

Calculated phonon modes, infrared, and Raman spectra in ZnGeGa2N4

W. Lambrecht, Amol Ratnaparkhe, 2020 .

First-principles calculations of phonon derived Raman and infrared spectra in Be-IV-N2 compounds

Yuheng Liu, W. Lambrecht, S. Lyu, 2019, Journal of Physics D: Applied Physics.

Quasiparticle self-consistent GW electronic band structure of Cd-IV-N2 compounds

W. Lambrecht, S. Lyu, 2017 .

Electronic Structure and Optical Properties of ZnGeN2

S. Rashkeev, S. Limpijumnong, W. Lambrecht, 1999 .

Electronic Structure and Optical Properties of ZnGeN 2

S. Rashkeev, S. Limpijumnong, W. Lambrecht, 1998 .

Band alignment of III-N, ZnO and II–IV-N2 semiconductors from the electron affinity rule

W. Lambrecht, S. Lyu, 2019, Journal of Physics D: Applied Physics.

Ordering in the mixed ZnGeN2 -GaN alloy system: Crystal structures and band structures of ZnGeGa2N4 from first principles

Santosh Kumar Radha, W. Lambrecht, K. Kash, 2018, Physical Review Materials.

Ordering in the mixed ZnGeN_{2}-GaN alloy system: Crystal structures and band structures of ZnGeGa_{2}N_{4} from first principles

Santosh Kumar Radha, W. Lambrecht, K. Kash, 2019 .

Vibrational modes in the Pmc2 1 structure of ZnGeN 2

W. Lambrecht, Mark Hagemann, Churna Bhandari, 2016 .

CdGeN2 and ZnGe0.5Sn0.5N2: Two New Nitride Semiconductors with Band Gaps in the Blue-Green

W. Lambrecht, Atchara Punya, 2012 .

First-Principles Calculations of Elasticity, Polarization-Related Properties, and Nonlinear Optical Coefficients in Zn-IV-N2 Compounds

Walter R. L. Lambrecht, W. Lambrecht, T. Paudel, 2009 .

Vibrational modes inZnGeN2: Raman study and theory

T. Peshek, W. Lambrecht, K. Kash, 2008 .

Band-gap bowing inAgGa(Se1−xTex)2and its effect on the second-order response coefficient and refractive indices

W. Lambrecht, C. Mitra, 2007 .

Electronic structure of wide-band-gap ternary pnictides with the chalcopyrite structure.

A. Petukhov, B. Segall, Segall, 1994, Physical review. B, Condensed matter.

Quasiparticle self-consistent GW band structures of Mg-IV-N2 compounds: The role of semicore d states

W. Lambrecht, S. Lyu, 2019, Solid State Communications.

First-principles study of n- and p-type doping opportunities in LiGaO2

W. Lambrecht, Adisak Boonchun, Klichchupong Dabsamut, 2020, Journal of Physics D: Applied Physics.

Band offsets between ZnGeN 2 , GaN, ZnO, and ZnSnN 2 and their potential impact for solar cells

Walter R. L. Lambrecht, W. Lambrecht, Atchara Punya, 2013 .

THEORETICAL STUDY OF THE BAND OFFSETS AT GAN/ALN INTERFACES

B. Segall, W. Lambrecht, E. Albanesi, 1994 .

First-principles calculations of elastic and piezoelectric constants and spontaneous polarization in Cd-IV-N2 compounds

W. Lambrecht, S. Lyu, 2018, Journal of Applied Physics.

Identification of Raman-active phonon modes in oriented platelets of InN and polycrystalline InN

J. Angus, Kwiseon Kim, J. Dyck, 2000 .

Electronic Structure and Magnetic Properties of Transition Metal Doped Silicon Carbide in Different Polytypes

M. Miao, W. Lambrecht, 2006 .

Electrical Characterization and Charge Transport in Chemically Exfoliated 2D LixCoO2 Nanoflakes

Santosh Kumar Radha, A. Sehirlioglu, Xuan P. A. Gao, 2020 .

Anomalous band-gap behavior and phase stability of c-BN-diamond alloys.

B. Segall, Segall, W. Lambrecht, 1993, Physical review. B, Condensed matter.

Electronic structure of (diamond C)/(sphalerite BN) (110) interfaces and superlattices.

B. Segall, Segall, W. Lambrecht, 1989, Physical review. B, Condensed matter.

Real-space representation of the quasiparticle self-consistent GW self-energy and its application to defect calculations

M. van Schilfgaarde, W. Lambrecht, D. Skachkov, 2022, Physical Review B.

Quasiparticle self-consistent GW band structures and high-pressure phase transitions of LiGaO2 and NaGaO2

Santosh Kumar Radha, W. Lambrecht, Amol Ratnaparkhe, 2020, Physical Review B.

Buckled honeycomb group-$V$--$S_6$ symmetric $(d-2)$ higher order topological insulators

Santosh Kumar Radha, W. Lambrecht, 2020, 2003.12656.

Superparamagnetism in Gd-doped GaN induced by Ga-vacancy clustering

S. Blügel, P. Dederichs, R. Zeller, 2012 .

Large band-gap bowing inCu1−xAgxGaS2chalcopyrite semiconductors and its effect on optical parameters

W. Lambrecht, C. Mitra, 2007 .

Schottky barrier formation at ErAs/GaAs interfaces: a case of Fermi level pinning by surface states

A. Petukhov, W. Lambrecht, B. Hemmelman, 1998 .

Pseudopotential linear response method for core hole screening in metals

N. Castellani, W. Lambrecht, D. Leroy, 1985 .

Topological obstructed atomic limit insulators by annihilating Dirac fermions

Santosh Kumar Radha, W. Lambrecht, 2021 .

Topological obstructed atomic limit by annihilating Dirac fermions

Santosh Kumar Radha, W. Lambrecht, 2020, 2011.04098.

Band-gap bowing in Ga1−xInxN alloys

Walter R. L. Lambrecht, W. Lambrecht, 1997 .

Characterization Of Bulk, Polycrystalline Indium Nitride Grown At Sub-Atmospheric Pressures

John C. Angus, Kathleen Kash, Walter R. L. Lambrecht, 1997 .

Theoretical Study of Group-III-Nitride Alloys

Kwiseon Kim, S. Limpijumnong, B. Segall, 1996 .

Electronic structure of GaN with strain and phonon distortions.

Kim, B. Segall, Segall, 1994, Physical review. B, Condensed matter.

Electronic structure of SiC-TiC interfaces

B. Segall, W. Lambrecht, 1992 .

Effects of structural relaxation, interdiffusion, and surface termination on two-dimensional electron gas formation at theLaAlO3/SrTiO3(001) interface

W. Lambrecht, Ittipon Fongkaew, Sukit Limpijumnnong, 2015 .

Electron microscopy and spectroscopic study of structural changes, electronic properties, and conductivity in annealed LixCoO2

Santosh Kumar Radha, A. Sehirlioglu, Xuan P. A. Gao, 2020, Physical Review Materials.

Lattice polarization effects on the screened Coulomb interaction $W$ of the GW approximation

Walter R. L. Lambrecht, Mark van Schilfgaarde, M. Schilfgaarde, 2017, 1706.10252.

W. Lambrecht, Churna Bhandari, 2014 .

On the origin of the split-off conduction bands in V2O5

B. Djafari-Rouhani, J. Vennik, W. Lambrecht, 1981 .

Electronic structure and properties of NiSi2 and CoSi2 in the fluorite and adamantane structures.

Christensen, Blöchl, P. Blöchl, 1987, Physical review. B, Condensed matter.

Electronic structure and magnetism in P4/nmm KCoO2

Santosh Kumar Radha, W. Lambrecht, Ozan Dernek, 2024, 2402.11030.

First-principles calculations of phonons and Raman spectra in monoclinic CsSnCl$_3$

W. Lambrecht, Ling-Yi Huang, 2015 .

Application of generalized gradient-corrected density functionals to iron.

B. Segall, Segall, W. Lambrecht, 1992, Physical review. B, Condensed matter.

Robustness of electronic screening effects in electron spectroscopies: Example of V2O5

W. Lambrecht, M. Gatti, V. Gorelov, 2023, Physical Review B.

Which electronic structure method for the study of defects: A commentary

W. Lambrecht, 2011 .

Effects of the van der Waals Interactions on Structural and Electronic Properties of CH3NH3(Pb,Sn)(I,Br,Cl)3 Halide Perovskites

S. Limpijumnong, S. Jungthawan, W. Lambrecht, 2020, ACS omega.

Optoelectronic Dichotomy of Mixed Halide CH3NH3Pb(Br1- xCl x)3 Single Crystals: Surface versus Bulk Photoluminescence.

Yixin Zhao, C. Burda, Taiyang Zhang, 2018, Journal of the American Chemical Society.