Serveur d'exploration sur l'Indium

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Density functional method And NotWEI ZHAO

List of bibliographic references

Number of relevant bibliographic references: 76.
Ident.Authors (with country if any)Title
000022 Influences of the type of dopant and substrate on ferromagnetism in ZnO:Mn
000074 The structural, elastic and thermoelectric properties of Fe2VAl at pressures
000076 The electronic and optical properties of indium doped zinc oxide nanosheets
000077 The electronic and optical properties of InGaN-based solar cells alloys: First-principles investigations via mBJLDA approach
000093 Synthesis and Properties of High-Performance Functional Polyimides Containing Rigid Nonplanar Conjugated Tetraphenylethylene Moieties
000118 Roles of oxygen vacancy on ferromagnetism in Ni doped In2O3: A hybrid functional study
000130 Pressure based first-principles study of the electronic, elastic, optic and phonon properties of zincblende InN
000156 Phase Separation Induced by Au Catalysts in Ternary InGaAs Nanowires
000181 Martensitic transformation in Heusler alloy Mn2PtIn: Theoretical and experimental investigation
000251 First-principles study on stability, electronic and thermodynamic properties of Ti2Coln and Ti2Niln
000252 First-principles investigation of the optical properties of CuIn (SxSe1-x)2
000253 First principles calculations for band-gap energy properties of non-polar and semi-polar ternary nitride alloys under in-plane strain
000297 Density functional theory study the effects of point defects in β-In2S3
000320 Band Edge Modulation and Light Emission in InGaN Nanowires Due to the Surface State and Microscopic Indium Distribution
000321 Atomistic structures and phase transition of In2Se3 nanowires studied by DFT calculations and synchrotron radiation X-ray diffraction
000366 The structural, elastic and thermodynamical properties of zinc-blend structure InN from first principles
000401 Structure of AgI-doped Ge-In-S glasses: Experiment, reverse Monte Carlo modelling, and density functional calculations
000455 Optical properties of Al-doped CuInSe2 from the first principle calculation
000481 Lattice vibrations and optical properties of wurtzite InN in the reststrahlen region
000494 InN doped with Zn: Bulk and surface investigation from first principles
000499 In assisted realization of p-type C-doped ZnO: A first-principles study
000527 First-principles studies of structural, mechanical, electronic, optical properties and pressure-induced phase transition of CuInO2 polymorph
000528 First-principle study of the electronic and optical properties of BInGaAs quaternary alloy lattice-matched to GaAs
000529 First principles study on the p-type transparent conducting properties of rutile Ti1-xInxO2
000531 Ferromagnetism induced by oxygen-vacancy complex in (Mn, in) codoped ZnO
000548 Enhanced doping efficiency of the remotely p-doped InAs/InP core-shell nanowires: A first principles study
000580 Effect of Molecular Passivation on the Doping of InAs Nanowires
000592 DFT and Experimental Exploration of the Mechanism of InCl3-Catalyzed Type II Cycloisomerization of 1,6-Enynes: Identifying InCl2+ as the Catalytic Species and Answering Why Nonconjugated Dienes Are Generated
000593 DFT Study of CO2 Adsorption and Hydrogenation on the In2O3 Surface
000614 Band-Edge Electronic Structure of β-In2S3: The Role of s or p Orbitals of Atoms at Different Lattice Positions
000666 Theoretical investigation on the structural, dynamical, and thermodynamic properties of the zinc-blende InX (X=P, As, Sb)
000712 Stable structure and effects of oxygen on InN (1 0 1 0) and (1 1 2 0) surfaces
000735 Pressure effect on the structural and elastic property of Hf2InC
000736 Preserving the half-metallicity at the surfaces of rocksalt CaN and SrN and the interfaces of CaN/InN and SrN/GaP: a density functional study
000754 P-n codoping induced enhancement of ferromagnetism in Mn-doped In2O3: A first-principles study
000852 First-principles study of InAs, InxGa1-xSb nanotubes and InAs/InxGa1-xSb nanotube superlattices
000855 Ferromagnetic properties of Cu-doped ZnS: A density functional theory study
000990 Theoretical Study on Hetero-Diels-Alder Reaction of Butadiene with Benzaldehyde Catalyzed by Chiral InIII Complexes
000A38 Structural and electronic properties of amorphous InSb from first principles study
000A90 Mobility enhancement of p-type SnO2 by In-Ga co-doping
000B47 First-principles study of phase transition and thermodynamic properties of InP
000B48 First-principles study of Sr adsorption on InN (0001)
000B73 Electronic structures and optical properties of Cu1-xNaxInSe2 by first-principle calculations
000B74 Electron localization and emission mechanism in wurtzite (Al, In, Ga)N alloys
000B89 Elastic properties and electronic structures of antiperovskite-type InNCo3 and InNNi3
000C26 Binding of In and Pb surfactants on Cu{1 1 1} surfaces
000C35 Ab initio study of electronic structures of InAs and GaSb nanowires along various crystallographic orientations
000C88 The effects of alloying elements Al and In on Ni-Mn-Ga shape memory alloys, from first principles
000C93 The adsorption of In on the surface of (0 0 1) CdTe
000C99 Synthesis, crystal structure and optical properties of an indium phosphate K3In3P4O16
000D14 Syntheses, crystal and electronic structures of two new lead indium phosphates: Pb2In4P6O23 and Pb2InP3O11
000D41 Size Independence and Doping Dependence of Bending Modulus in ZnO Nanowires
000D46 Roles of sodium induced defects in CuInSe2 by first principles calculation
000D86 Optical properties of amorphous III-V compound semiconductors from first principles study
000E58 First-principles study of indium adsorption on GaP(001)(2 x 1) surface
000E59 First-principles study of Mg incorporation at wurtzite InN (0 0 01 ) and (0001) surfaces
000E60 First-principles calculations on structure and elasticity of wurtzite-type indium nitride under pressure
000E61 First principles study on the properties of p-type conducting In:SnO2
000E62 First principles study of electronic and optical properties of zincblende InP
000E84 Electrosynthesis of polyfluorene in an ionic liquid and characterization of its stable electrocatalytic activity for formic acid oxidation
000E88 Electronic structure and optical properties of In doped SrTiO3/MgO(001)
000E89 Electronic and optical properties of orthorhombic LiInS2 and LiInSe2: A density functional theory investigation
001067 Phase transition, and elastic and thermodynamic properties of InN derived from first-principles and the quasi-harmonic Debye model
001144 First-principles calculation of electronic structures and optical properties of wurtzite InxAl1-xN alloys
001161 Electronic structures and optical properties of wurtzite type LiBSe2 (B = Al, Ga, In) : A first-principles study
001356 Microscopic origin of electrical compensation in arsenic-doped HgCdTe by molecular beam epitaxy : Density functional study
001520 The effects of a stress field and chemical diffusion on electronic behaviour in InAs/GaAs quantum dots
001626 First-principles studies on the pressure dependences of the stress-strain relationship and elastic stability of semiconductors
001638 Energetics of the growth mode transition in InAs/GaAs(001) small quantum dot formation : A first-principles study
001672 Crystal structures of alkali-metal indium (III) phosphates of [M3In(PO4)2]N (M = K, n = 10; M = Rb, n = 2) compounds, and band structures and chemical bond properties of [Rb3In(PO4)2]2 crystal
001736 Stability and electronic structure of single-walled InN nanotubes
001A17 Experimental and theoretical studies of the propargyl-allenylindium system
001C67 First-principles identification of quasi-two-dimensional Fermi surface nesting on a metallic c(2×2)-In/Cu(001) surface
001C72 Ab initio studies of structural stability and magnetism in Ni3In
001D16 Theoretical study of C1========Pi;-x1Σ+ transition of InCl
001E11 19F NMR chemical shielding for metal fluorides MF2(M = Zn, Cd, Pb), MF3 (M = Al, Ga, in) and SnF4

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