Stephan Lany
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Computer Science
Stephan Lany's Degrees
- PhD Computer Science Stanford University
- Masters Computer Science University of California, Berkeley
- Bachelors Computer Science University of California, Berkeley
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(Suggest an Edit or Addition)Stephan Lany's Published Works
Number of citations in a given year to any of this author's works
Total number of citations to an author for the works they published in a given year. This highlights publication of the most important work(s) by the author
Published Works
- Assessment of correction methods for the band-gap problem and for finite-size effects in supercell defect calculations: Case studies for ZnO and GaAs (2008) (805)
- Dopability, intrinsic conductivity, and nonstoichiometry of transparent conducting oxides. (2007) (498)
- Anion vacancies as a source of persistent photoconductivity in II-VI and chalcopyrite semiconductors (2005) (493)
- Origins of the p-Type Nature and Cation Deficiency in Cu2O and Related Materials (2007) (376)
- Correcting Density Functional Theory for Accurate Predictions of Compound Enthalpies of Formation:Fitted elemental-phase Reference Energies (FERE) (2012) (358)
- Band-structure, optical properties, and defect physics of the photovoltaic semiconductor SnS (2012) (349)
- n -type doping of CuIn Se 2 and CuGa Se 2 (2005) (302)
- Accurate prediction of defect properties in density functional supercell calculations (2009) (283)
- Light- and bias-induced metastabilities in Cu(In,Ga)Se2 based solar cells caused by the (VSe-VCu) vacancy complex (2006) (279)
- Defect Tolerant Semiconductors for Solar Energy Conversion. (2014) (271)
- Polaronic Hole Localization and Multiple Hole Binding of Acceptors in Oxide Wide-Gap Semiconductors (2009) (249)
- Magnetism without magnetic ions: percolation, exchange, and formation energies of magnetism-promoting intrinsic defects in CaO. (2006) (248)
- The electronic structure of chalcopyrites—bands, point defects and grain boundaries (2010) (232)
- Charge self-regulation upon changing the oxidation state of transition metals in insulators (2008) (216)
- Assessing capability of semiconductors to split water using ionization potentials and electron affinities only. (2014) (208)
- A map of the inorganic ternary metal nitrides (2018) (202)
- Intrinsic defects in ZnO calculated by screened exchange and hybrid density functionals (2010) (193)
- Origins of the doping asymmetry in oxides : hole doping in NiO versus electron doping in ZnO (2007) (179)
- The quest for dilute ferromagnetism in semiconductors: Guides and misguides by theory (2010) (173)
- Doping Rules and Doping Prototypes in A2BO4 Spinel Oxides (2011) (165)
- Semiconducting transition metal oxides (2015) (162)
- Iron Chalcogenide Photovoltaic Absorbers (2011) (148)
- Atomic control of conductivity versus ferromagnetism in wide-gap oxides via selective doping: V, Nb, Ta in anatase TiO2. (2008) (142)
- Band-Structure Calculations for the 3d Transition Metal Oxides in GW (2013) (137)
- Control of Doping in Cu2SnS3 through Defects and Alloying (2014) (126)
- Electronic structures of Cu2O, Cu4O3, and CuO: A joint experimental and theoretical study (2016) (126)
- Intrinsic DX centers in ternary chalcopyrite semiconductors. (2008) (124)
- Physical descriptor for the Gibbs energy of inorganic crystalline solids and temperature-dependent materials chemistry (2018) (118)
- The 2019 materials by design roadmap (2018) (111)
- Evaluation of photovoltaic materials within the Cu-Sn-S family (2013) (111)
- A Computational Framework for Automation of Point Defect Calculations (2016) (110)
- n-type doping of CuInSe2 and CuGaSe2 (2005) (109)
- Many-body GW calculation of the oxygen vacancy in ZnO (2009) (108)
- Generalized Koopmans Density Functional Calculations Reveal the Deep Acceptor State of NO in ZnO (2010) (108)
- Self-regulated growth and tunable properties of CuSbS2 solar absorbers (2015) (106)
- Revisiting the Valence and Conduction Band Size Dependence of PbS Quantum Dot Thin Films. (2016) (106)
- The electronic consequences of multivalent elements in inorganic solar absorbers: Multivalency of Sn in Cu2ZnSnS4 (2010) (106)
- Magnetic Interactions of Cr-Cr and Co-Co Impurity Pairs in ZnO within a Band-Gap Corrected Density-Functional Approach (2008) (103)
- Theoretical prediction and experimental realization of new stable inorganic materials using the inverse design approach. (2013) (103)
- Perovskite-Inspired Photovoltaic Materials: Toward Best Practices in Materials Characterization and Calculations (2017) (98)
- Control of the Electrical Properties in Spinel Oxides by Manipulating the Cation Disorder (2014) (98)
- Thermodynamic Routes to Novel Metastable Nitrogen-Rich Nitrides (2017) (97)
- Surface origin of high conductivities in undoped In2O3 thin films. (2012) (96)
- Semiconductor Thermochemistry in Density Functional Calculations (2008) (95)
- Roadmap on optical energy conversion (2016) (94)
- Nonstoichiometry as a source of magnetism in otherwise nonmagnetic oxides : Magnetically interacting cation vacancies and their percolation (2007) (92)
- Dual nature of acceptors in GaN and ZnO: The curious case of the shallow MgGa deep state (2010) (85)
- Electronic correlation in anion p orbitals impedes ferromagnetism due to cation vacancies in Zn chalcogenides. (2009) (82)
- Electronic structure, donor and acceptor transitions, and magnetism of 3d impurities in In2O3 and ZnO (2009) (81)
- Defect phase diagram for doping of Ga2O3 (2018) (77)
- CuSbSe2 photovoltaic devices with 3% efficiency (2015) (76)
- Inverse design approach to hole doping in ternary oxides: Enhancing p-type conductivity in cobalt oxide spinels (2011) (73)
- Cation Off-Stoichiometry Leads to High p-Type Conductivity and Enhanced Transparency in Co2ZnO4 and Co2NiO4 Thin Films (2012) (72)
- Accelerated development of CuSbS2 thin film photovoltaic device prototypes (2015) (68)
- Why can CuInSe2 be readily equilibrium-doped n-type but the wider-gap CuGaSe2 cannot? (2004) (68)
- A review of defects and disorder in multinary tetrahedrally bonded semiconductors (2016) (67)
- Effects of disorder on carrier transport in Cu$_2$SnS$_3$ (2015) (66)
- Semiconducting transition-metal oxides based on d 5 cations: Theory for MnO and Fe 2 O 3 (2012) (65)
- Convergence of density and hybrid functional defect calculations for compound semiconductors (2013) (65)
- Entropy-Driven Clustering in Tetrahedrally Bonded Multinary Materials (2015) (63)
- Monte Carlo Simulations of Disorder in ZnSnN2 and the Effects on the Electronic Structure (2017) (60)
- Non-equilibrium deposition of phase pure Cu2O thin films at reduced growth temperature (2014) (58)
- Non-equilibrium origin of high electrical conductivity in gallium zinc oxide thin films (2013) (56)
- Li‐Doped Cr2MnO4: A New p‐Type Transparent Conducting Oxide by Computational Materials Design (2013) (56)
- The role of decomposition reactions in assessing first-principles predictions of solid stability (2018) (52)
- Metal-dimer atomic reconstruction leading to deep donor states of the anion vacancy in II-VI and chalcopyrite semiconductors. (2004) (52)
- Experimental Synthesis and Properties of Metastable CuNbN2 and Theoretical Extension to Other Ternary Copper Nitrides (2014) (52)
- Control of ferromagnetism via electron doping in In2O3:Cr. (2008) (51)
- Predicting polaronic defect states by means of generalized Koopmans density functional calculations (2011) (51)
- Ternary nitride semiconductors in the rocksalt crystal structure (2018) (48)
- Trade‐Offs in Thin Film Solar Cells with Layered Chalcostibite Photovoltaic Absorbers (2017) (47)
- Angle-resolved photoemission and quasiparticle calculation of ZnO: The need for d band shift in oxide semiconductors (2012) (46)
- Enhanced Electron Mobility Due to Dopant‐Defect Pairing in Conductive ZnMgO (2014) (45)
- Redox-Mediated Stabilization in Zinc Molybdenum Nitrides. (2018) (45)
- Effect of extended strain fields on point defect phonon scattering in thermoelectric materials. (2015) (44)
- Impurity clustering and ferromagnetic interactions that are not carrier induced in dilute magnetic semiconductors: the case of Cu2O:Co. (2007) (42)
- Design of Semiconducting Tetrahedral Mn 1 − x Zn x O Alloys and Their Application to Solar Water Splitting (2015) (42)
- Selection Metric for Photovoltaic Materials Screening Based on Detailed-Balance Analysis (2017) (42)
- Band or Polaron: The Hole Conduction Mechanism in the p-Type Spinel Rh2ZnO4 (2012) (41)
- Two-dimensional polaronic behavior in the binary oxides m-HfO2 and m-ZrO2. (2012) (41)
- Semiconducting properties of spinel tin nitride and other IV3N4 polymorphs (2015) (41)
- Novel phase diagram behavior and materials design in heterostructural semiconductor alloys (2017) (40)
- Prediction of A2BX4 metal-chalcogenide compounds via first-principles thermodynamics (2012) (39)
- Computationally Driven Two-Dimensional Materials Design: What Is Next? (2017) (38)
- Polymorphic energy ordering of MgO, ZnO, GaN, and MnO within the random phase approximation (2013) (38)
- Interplay between Composition, Electronic Structure, Disorder, and Doping due to Dual Sublattice Mixing in Nonequilibrium Synthesis of ZnSnN2:O (2019) (35)
- Group V acceptors in CdTe: Ab initio calculation of lattice relaxation and the electric-field gradient (2000) (35)
- Comment on "Intrinsic n-type behavior in transparent conducting oxides: a comparative hybrid-functional study of In2O3, SnO2, and ZnO". (2011) (35)
- Utilizing Site Disorder in the Development of New Energy-Relevant Semiconductors (2020) (34)
- Structural and electronic modification of photovoltaic SnS by alloying (2014) (32)
- Negative-pressure polymorphs made by heterostructural alloying (2018) (31)
- Combinatorial synthesis of magnesium tin nitride semiconductors. (2020) (30)
- Using design principles to systematically plan the synthesis of hole-conducting transparent oxides: Cu3VO4 and Ag3VO4 as a case study (2011) (30)
- Exciton photoluminescence and benign defect complex formation in zinc tin nitride (2018) (30)
- Thin Film Synthesis of Semiconductors in the Mg–Sb–N Materials System (2019) (30)
- Synthesis of a mixed-valent tin nitride and considerations of its possible crystal structures. (2016) (29)
- Halogen n-type doping of chalcopyrite semiconductors (2005) (28)
- The Failure of LDA and GGA to describe Relative Stability, Electronic Structure and Magnetism of MnN and (Ga,Mn)N Alloys (2008) (27)
- Pathway to oxide photovoltaics via band-structure engineering of SnO (2015) (27)
- Electronic structures of Cu 2 O , Cu 4 O 3 , and CuO : A joint experimental and theoretical study (2019) (27)
- Vacancies in CdTe: experiment and theory (2001) (26)
- Understanding and Control of Bipolar Self-Doping in Copper Nitride. (2016) (26)
- Asymmetric Cation stoichiometry in Spinels : Site occupancy in Co$_{2}$ZnO$_{4}$ and Rh$_{2}$ZnO$_{4}$ (2011) (24)
- Characterization of defects in copper antimony disulfide (2017) (24)
- Design of Metastable Tin Titanium Nitride Semiconductor Alloys (2017) (24)
- Non-equilibrium alloying controls optoelectronic properties in Cu2O thin films for photovoltaic absorber applications (2015) (23)
- Nonstoichiometry and hole doping in NiO (2010) (22)
- Zn2SbN3: growth and characterization of a metastable photoactive semiconductor (2019) (20)
- Computational discovery of stable and metastable ternary oxynitrides. (2021) (19)
- Using heterostructural alloying to tune the structure and properties of the thermoelectric Sn1−xCaxSe (2017) (18)
- Non-equilibrium synthesis, structure, and opto-electronic properties of Cu2−2xZnxO alloys (2015) (18)
- Composition Dependence of the Band Gap and Doping in Cu 2 O -Based Alloys as Predicted by an Extension of the Dilute-Defect Model (2014) (18)
- Synthesis and Characterization of (Sn,Zn)O Alloys (2016) (18)
- Perfect short-range ordered alloy with line-compound-like properties in the ZnSnN2:ZnO system (2020) (17)
- Extended antisite defects in tetrahedrally bonded semiconductors (2015) (17)
- Communication: The electronic entropy of charged defect formation and its impact on thermochemical redox cycles. (2018) (17)
- Density functional theory calculations establish the experimental evidence of the DX center atomic structure in CdTe. (2004) (17)
- Band Edge Positions and Their Impact on the Simulated Device Performance of ZnSnN2-Based Solar Cells (2018) (16)
- Co 3O 4-Co 2ZnO 4 spinels: The case for a solid solution (2012) (16)
- Spin-orbit coupling effects on predicting defect properties with hybrid functionals: A case study in CdTe (2018) (15)
- Semiconducting cubic titanium nitride in the Th 3 P 4 structure (2018) (15)
- Energetics of quaternary III-V alloys described by incorporation and clustering of impurities (2009) (15)
- Defect complexes formed with Ag atoms in CdTe, ZnTe, and ZnSe (2000) (15)
- Generalized Valence-Force-Field Model of (Ga,In)(N,P) Ternary Alloys (2008) (15)
- Electron scattering mechanisms in polycrystalline sputtered zinc tin oxynitride thin films (2019) (13)
- Experimental Synthesis of Theoretically Predicted Multivalent Ternary Nitride Materials (2022) (13)
- Zinc-Stabilized Manganese Telluride with Wurtzite Crystal Structure (2018) (13)
- Multivalency of Group 15 Dopants in SnO2 (2014) (12)
- Limitation of the open-circuit voltage due to metastable intrinsic defects in Cu(In,Ga)Se2 and strategies to avoid these defects (2008) (12)
- Experimental Characterization of a Theoretically Designed Candidate p-Type Transparent Conducting Oxide: Li-Doped Cr2MnO4 (2014) (12)
- Defect interactions of group-I elements in cubic II-VI compounds (2003) (12)
- Probing configurational disorder in ZnGeN2 using cluster-based Monte Carlo (2021) (12)
- Photoluminescence study of II-VI semiconductors by using radioactive 71As dopants (2001) (11)
- Optical properties of the isoelectronic trap Hg in ZnO (2003) (11)
- Polymorphism, band-structure, band-lineup, and alloy energetics of the group II oxides and sulfides MgO, ZnO, CdO, MgS, ZnS, CdS (2014) (11)
- Solubility limits in quaternary SnTe-based alloys (2017) (11)
- Identification of Defects in Semiconductors via their Electric Field Gradients (2001) (10)
- The effect of sub-oxide phases on the transparency of tin-doped gallium oxide (2016) (10)
- Computational Fermi level engineering and doping-type conversion of Mg:Ga2O3 via three-step synthesis process (2021) (10)
- Bandgap analysis and carrier localization in cation-disordered ZnGeN2 (2021) (9)
- Identification of Ag-acceptors in 111Ag/111Cd doped ZnTe and CdTe (2000) (8)
- Modeling amorphous thin films: Kinetically limited minimization (2014) (8)
- Metal chalcogenides for neuromorphic computing: emerging materials and mechanisms (2021) (8)
- Wild band edges: The role of bandgap grading and band-edge fluctuations in high-efficiency chalcogenide devices (2016) (8)
- Combinatorial investigation of structural and optical properties of cation-disordered ZnGeN2 (2020) (8)
- DX-centers in CdTe and ZnTe observed by locally sensitive probe atoms (2003) (7)
- Quantum-dot intermediate-band solar cells with inverted band alignment (2008) (6)
- Conduction band position tuning and Ga-doping in (Cd,Zn)S alloy thin films (2017) (6)
- Accelerated development of CuSbS 2 thin film photovoltaic device prototypes : Accelerated development of CuSbS 2 thin film photovoltaic device prototypes (2016) (6)
- Defect complexes induced by diffusion of group I acceptors into CdTe (1999) (5)
- High-Throughput Experimental Study of Wurtzite Mn1–xZnxO Alloys for Water Splitting Applications (2019) (4)
- Templated Growth of Metastable Polymorphs on Amorphous Substrates with Seed Layers (2020) (4)
- ZnxMn1–xO Solid Solutions in the Rocksalt Structure: Optical, Charge Transport, and Photoelectrochemical Properties (2018) (4)
- The role of disorder in the synthesis of metastable ternary nitrides (2020) (4)
- Oxidation numbers as Social Security Numbers: Are they predictive or postdictive? (2009) (4)
- n-type doping principles for doping CuInSe/sub 2/ and CuGaSe/sub 2/ with Cl, Br, I, Mg, Zn, and Cd (2005) (4)
- Experimental Synthesis and Properties of Metastable CuNbN2 and Theoretical Extension to Other Ternary Copper Nitrides. (2014) (3)
- Multivalency of Sn in Cu$_{2}$ZnSnS$_{4}$ (2010) (3)
- Light-and bias-induced metastabilities in based solar cells caused by the vacancy complex (2017) (3)
- Formation of 6H-Ba3Ce0.75Mn2.25O9 during Thermochemical Reduction of 12R-Ba4CeMn3O12: Identification of a Polytype in the Ba(Ce,Mn)O3 Family. (2022) (3)
- Defect identification by means of electric field gradient calculation (2001) (3)
- Role of disorder in the synthesis of metastable zinc zirconium nitrides (2020) (3)
- Exploring the Phase Space of Zn2SbN3, a Novel Semiconducting Nitride (2021) (3)
- Short-Range Order Tunes Optical Properties in Long-Range Disordered ZnSnN2–ZnO Alloy (2022) (3)
- Machine Learning the Gibbs Energies of Inorganic Crystalline Solids (2018) (1)
- The Incorporation and Complex Formation of Ag Acceptors in CdTe (1998) (1)
- Direct link between disorder, mobility and magnetoresistance in topological semimetals (2022) (1)
- Wurtzite materials in alloys of rock salt compounds (2020) (1)
- Light-induced metastability in Cu(In,Ga)Se2 caused by VSe-VCu complexes (2005) (1)
- Tuning optical absorption of SnO by isoelectronic alloying for PV absorber (2015) (1)
- Computational Materials Design: Interplay between Composition, Electronic Structure, Disorder, and Doping due to Dual Sublattice Mixing in Nonequilibrium Synthesis of ZnSnN 2 :O (Adv. Mater. 11/2019) (2019) (1)
- Role of cation disorder in carrier localization and density of states in ZnGeN2 (2021) (1)
- Combinatorial Synthesis of Cation-Disordered Manganese Tin Nitride MnSnN2 Thin Films with Magnetic and Semiconducting Properties (2022) (1)
- A new paradigm for thin-film solar cells: the case of Earth abundant Cu-N ternary compounds (2013) (1)
- Compositionally Complex Perovskite Oxides for Solar Thermochemical Water Splitting (2022) (1)
- First principles predictions of SnO2/CdTe and SnO2/CdCl2/CdTe interface structures (2021) (1)
- Iron chalcogenide photovoltaic absorbers -- problems and opportunities (2012) (0)
- Deep-shallow transition and interplay between atomic and electronic structure (2004) (0)
- Single Phase Metastable Alloys by PLD-Layering (2017) (0)
- Development of (MnO)$_{\mathrm{1-x}}$(ZnO)$_{\mathrm{x}}$ Alloys for Water Splitting Applications (2014) (0)
- Pristine electronic properties in multinary semiconductor alloys at magic compositions (2019) (0)
- Physical descriptor for the Gibbs energy of inorganic crystalline solids and temperature-dependent materials chemistry (2018) (0)
- Accurate prediction of oxygen vacancy concentration with disordered A-site cations in high-entropy perovskite oxides (2023) (0)
- Thermodynamics of semiconductor doping and stoichiometry from first-principles methods (2006) (0)
- S0884291419004023 972..980 (2020) (0)
- Doping Rules in A$_{2}$BO$_{4}$ Spinel Oxides (2011) (0)
- Electron Doping of Proposed Kagome Quantum Spin Liquid Produces Localized Electrons in Band Gap States but Not Free Electrons (2018) (0)
- Theoretical Prediction and Experimental Realization of Missing Materials (2013) (0)
- Charge regulation via a negative feedback: transition metal atoms in semiconductors and insulators (2008) (0)
- Defect engineering of complex semiconductor alloys: Cu$_{\mathrm{2-2x}}$M$_{\mathrm{x}}$O$_{\mathrm{1-y}}$X$_{\mathrm{y}}$ (2013) (0)
- Magnetic 3$d$ interactions in ZnO and In$_{2}$O$_{3}$ in a band-gap corrected approach (2008) (0)
- Accurate surface ionization potentials and electron affinities of semiconductors and insulators, a step toward water splitting predictions (2013) (0)
- Structure prediction for metastable materials: Sn$_{\mathrm{\mathbf{2}}}$\textbf{N}$_{\mathrm{\mathbf{2}}}$ (2017) (0)
- Atomically thin interlayer phase from first principles enables defect-free incommensurate SnO2/CdTe interface (2022) (0)
- Roadmap Roadmap on optical energy conversion (2016) (0)
- Effect of Fermi level on Microstructure and Magnetism in (Ga,Mn)N Alloys (2008) (0)
- Self-consistent band-structure calculations at GW quality and DFT expense (2011) (0)
- The reason FeS$_2$ is not a good PV absorber (2011) (0)
- Localization, lattice distortion, charge transition levels, and magnetism of small-polaronic hole- and electron-states in wide-gap semiconductors (2010) (0)
- n quaternary SnTe-based alloys † (2017) (0)
- Spin-driven transition metal clustering in the wide-gap ferromagnetic semiconductor Cu$_2$O:Co (2007) (0)
- Intrinsic DX Centers in Ternary Chalcopyrite Semiconductors (Presentation) (2008) (0)
- Predicting properties of Zn 1+x Sn 1-x N 2-2x O 2x : defects and disorders (2018) (0)
- Antimony nitride discovered by theoretical structure prediction, rapid thermal annealing, and in situ X-ray diffraction (2022) (0)
- Multivalency of group-V elements in SnO$_2$ (2014) (0)
- Searching for new transparent conducting oxides( TCO) for energy applications within the A$_2$BO$_4$ family using defect calculations for A=Co, Rh, Ir and B=Mg, Ca, Ti, V, Cr, Mn, Fe, Co, Ni, Cu, Zn, Sr and Cd (2010) (0)
- Theoretical Evaluation of Cu-Sn-S and Cu-Sb-S Based Solar Absorbers for Earth-Abundant Thin-Film Solar Cells (2013) (0)
- First principles and valence force field study of III-V quaternary alloys (2008) (0)
- Non-equilibrium phase map, optical and electrical properties of Cu-Zn-O alloys (2014) (0)
- Defect formation enthalpy of Cu2ZnSnS4 and Cu2ZnSnSe4 revisited: ab initio insights into the limitations of CZTS technology (2014) (0)
- Prediction of novel, Earth abundant Cu2O based alloys for PV applications (2014) (0)
- Combinatorial Synthesis of a New II-IV-N 2 : MgSnN 2 (2020) (0)
- From defects to alloys: Computational design of non-stoichiometric materials (2016) (0)
- Simulation and characterization of cation disorder in $$\hbox {ZnGeP}_{2}$$ (2022) (0)
- First principles investigations of defect-mediated carrier recombination centers in cadmium telluride (2017) (0)
- Simulated Structural and Electronic Properties of Cation-Disordered <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline" overflow="scroll"><mml:mrow><mml:mi>Zn</mml:mi><mml:mi>Ge</mml:mi><mml:mi mathvariant="normal">N</mml:mi></mml:mrow></mml:math> <mml:math xmlns:mml="http://w (2022) (0)
- Can wide-gap chalcopyrite be doped n-type (2005) (0)
- Developing new functional TCs (2016) (0)
- Experimental Realization of Theoretically Predicted New Stable Inorganic ABX Materials (2014) (0)
- Natural off-stoichiometry and asymmetry in $p$/$n$-dopability of wide-gap oxides$^{1}$ (2007) (0)
- Wild band edges: The role of bandgap grading and band-edge fluctuations in high-efficiency chalcogenide devices (2017) (0)
- Solar Cells: Trade‐Offs in Thin Film Solar Cells with Layered Chalcostibite Photovoltaic Absorbers (Adv. Energy Mater. 11/2017) (2017) (0)
- Theory-driven design of hole-conducting transparent oxides (2012) (0)
- Metastable defects are the origin of high conductivity in gallium doped zinc oxide (2014) (0)
- Title Roadmap on optical energy conversion Permalink (2016) (0)
- Structure prediction for metastable materials: Sn 2 N 2 (2017) (0)
- Defect levels of the O vacancy in ZnO in DFT, hybrid-DFT, and GW (2010) (0)
- Inclusion of the electron-phonon interaction in the BerkeleyGW computational package (2016) (0)
- Development of (MnO)1 -x (ZnO) x Alloys for Water Splitting Applications (2014) (0)
- Computational discovery of two-dimensional rare-earth iodides: promising ferrovalley materials for valleytronics (2022) (0)
- Property optimization in isovalent and aliovalent semiconductor alloys based on MnO (2013) (0)
- The effect of extended strain fields on point defect scattering (2016) (0)
- Light-induced metastability in the wide-gap ZnO and CuGaSe$_{2}$ caused by anion vacancies (2005) (0)
- Crystal structure prediction in novel nitrides: the roles of metastability and disorder (2018) (0)
- Thermochemical, structural and electronic properties of amorphous oxides, nitrides and sulfides (2015) (0)
- A few ways in which LDA et al can produce a wrong description of magnetism in oxides (2009) (0)
- A New Class of High Entropy Perovskite Oxides with Increased Reducibility and Stability for Solar Thermochemical Hydrogen Production (2021) (0)
- Title Thermodynamic Routes to Novel Metastable Nitrogen-Rich Nitrides Permalink (2017) (0)
- Defect-induced Ferromagnetism in Insulators without Magnetic Ions: The Case of Cation Vacancy in CaO (2006) (0)
- Origins of varying carrier concentration in Cu$_2$SnS$_3$ photovoltaic absorbers (2014) (0)
- Modeling of disorder in II-IV-V 2 semiconductors for tuning of novel properties (2019) (0)
- A Metastable Alloy (Sn$_{1-x}$Ca$_{x}$)S: Growth and Characterization (2015) (0)
- Design of Metastable Alloys for Energy Conversion (2016) (0)
- Design and discovery of heterostructural alloys (2016) (0)
- Harnessing non-stoichiometry and disorder in thermoelectric materials (2016) (0)
- Band-structure predictions for A2BX4 discovery compounds (2012) (0)
- Imitating beyond-DFT calculations via external on-site potentials (2020) (0)
- Fe$_{2}$MCh$_{4}$ (M=Si,Ge, Ch=S,Se): optical, electrical properties and defects (2012) (0)
- New Metastable Nitrogen Rich Nitrides of Titanium (2018) (0)
- Doping and defects by design: Ga2O3 (2016) (0)
- Electronic band structure and ambipolar electrical properties of Cu2O based semiconductor alloys (2014) (0)
- Chalcogenide Semiconductor Research and Applications (CSRA) (2018) (0)
- Searching for new solar absorber materials for energy applications within the Fe2(IV)VI4 family using electronic structure theory (2010) (0)
- S0884291419004023 1..9 (2020) (0)
- Self-trapping of holes in p-type oxides: Theory for small polarons in MnO (2012) (0)
- Novel Solar Energy Conversion Materials by Design of Mn(II) Oxides (2013) (0)
- 3d impurities in wide gap oxides---magnetism and carrier doping. (2009) (0)
- Synthesis and characterization of photoferroic BiCoO 3 (2018) (0)
- Phase stability of MnSe, MnTe, and VO 2 from total energies in the random phase approximation (2019) (0)
- Quaternary Ga$_{1-x}$In$_{x}$P$_{1-y}$N$_{y}$ alloys described by clustering of In and N in GaP (2009) (0)
- Investigating the Electronic Structure of Prospective Water-Splitting Oxide BaCe0.25Mn0.75O3−δ before and after Thermal Reduction (2022) (0)
- Addendum to “Convergence of density and hybrid functional defect calculations for compound semiconductors” (2017) (0)
- Thermodynamic Routes to Novel Stable and Metastable Nitride Semiconductors (2018) (0)
- Trends of semiconductivity in 3d oxides (2015) (0)
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Stephan Lany is affiliated with the following schools:
