Keywords: نقص نقطه; Ab initio calculations; Point defects; Stacking faults; Dislocation loops; Zirconium
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Keywords: نقص نقطه; Pulsed ion beams; Pump-probe; Point defects; Ion implantation; Semiconductors;
Keywords: نقص نقطه; FeCr; Atomistic simulation; Empirical potentials; Interstitials; Point defects; Benchmarking
Optical bleaching of the 375â¯Â°C TL peak, [GeO4/Li+]0 EPR center and OSL signal in irradiated natural quartz
Keywords: نقص نقطه; Thermoluminescence; Electron Paramagnetic Resonance; Optical Stimulated Luminescence; Point defects; Quartz;
A novel approach to quantifying the kinetics of point defect absorption at dislocations
Keywords: نقص نقطه; Point defects; Internal strain; Irradiated metals;
Band engineering and tuning thermoelectric transport properties of p-type Bi0.52Sb1.48Te3 by Pb doping for low-temperature power generation
Keywords: نقص نقطه; Thermoelectric materials; Spark plasma sintering; Thermal conductivity; Electrical properties; Point defects;
A FeNiMnC alloy with strain glass transition
Keywords: نقص نقطه; Strain glass transition; Elinvar alloys; Point defects; Nanosized domains;
Selective generation of Ag interstitial defects in Te-rich Bi2(Te,Se)3 using Ag nanoparticles causing significant improvement in thermoelectric performance
Keywords: نقص نقطه; Thermoelectric materials; Lattice defects; Interstitials; Point defects; Thermoelectric transport properties;
Luminescent performance of Ca2SnO4:Tb3+ phosphors with Li+ co-doping
Keywords: نقص نقطه; Phosphors; Solid state reaction; Point defects; Luminescence; X-ray diffraction;
Colossal permittivity in niobium doped BaTiO3 ceramics annealed in N2
Keywords: نقص نقطه; Colossal permittivity; Ceramics; Point defects; Dielectric;
Effect of anti-site point defects on the mechanical and thermodynamic properties of MgZn2, MgCu2 Laves phases: A first-principle study
Keywords: نقص نقطه; Point defects; Laves phases; Vibrational properties; Thermodynamic properties; Electronic properties;
Ab initio study of the stability of intrinsic and extrinsic Ag point defects in 3CSiC
Keywords: نقص نقطه; Fission product; Silicon carbide; Point defects; Density functional theory;
Primary radiation damage on displacement cascades in UO2, ThO2 and (U0.5Th0.5)O2
Keywords: نقص نقطه; Radiation damage; Displacement cascade; Pure oxide fuel; Mixed oxide fuel (MOX); Point defects; Molecular dynamics;
The location of Sb luminescence centers in Ca10(PO4)6F2 phosphors
Keywords: نقص نقطه; FAP; fluorapatite; m/m; mole of dopant per mole of Ca10(PO4)6F2 - unit of concentration; SbCa2; Sb at Ca2 site having effective charge +1; OF; oxygen at F site having effective charge â1; NaCa; sodium at Ca site having effective charge â1; VX; vacancy
Influence of point defects on optoelectronic properties of Al0.375Ga0.625N
Keywords: نقص نقطه; Point defects; First-principles; Band structure; Charge distribution; Optical properties;
First principles calculations for iodine atom diffusion in SiC with point defects
Keywords: نقص نقطه; Diffusion; Iodine; SiC; Point defects; First-principles calculations; Nudged elastic band method;
Vacancy formation enthalpies of high-entropy FeCoCrNi alloy via first-principles calculations and possible implications to its superior radiation tolerance
Keywords: نقص نقطه; FeCoCrNi; Point defects; Vacancy formation enthalpy; First-principles calculations; Modeling high-entropy alloys;
PyCDT: A Python toolkit for modeling point defects in semiconductors and insulators
Keywords: نقص نقطه; Point defects; Charged defects; Semiconductors; Insulators; Density functional theory; Python;
Role of pre-existing point defects on primary damage production and amorphization in silicon carbide (β-SiC)
Keywords: نقص نقطه; Silicon carbide; Point defects; Amorphization; Chemical disorder; Computer simulation;
Structural and electronic properties of point defects in Haeckelite GaN monolayer
Keywords: نقص نقطه; Haeckelite monolayer; Gallium nitride; Point defects; Density functional theory;
Irradiation-induced point defects enhance the electrochemical activity of 3C-SiC: An origin of SiC corrosion
Keywords: نقص نقطه; SiC; Point defects; Corrosion; Dopant;
Structural phenomena induced in the course of and post low-temperature KOBO extrusion of AA6013 aluminum alloy
Keywords: نقص نقطه; 6013 aluminum alloy; KOBO extrusion; Point defects; Microstructural observations; Mechanical properties;
Investigation of defects dependence of local piezoelectric response on Fe, La-modified (Pb,Sr)TiO3 thin films: A piezoresponse force microscopy study
Keywords: نقص نقطه; Point defects; Thin films; Piezoresponse force microscopy; Piezoelectric behavior;
On the interfacial phase growth and vacancy evolution during accelerated electromigration in Cu/Sn/Cu microjoints
Keywords: نقص نقطه; Multi-phase-field modeling; Cu/Sn/Cu solder interconnection; Electromigration; Point defects; Non-equilibrium vacancy evolution;
Twinning and charge compensation in Nb2O5-doped SnO2-CoO ceramics exhibiting promising varistor characteristics
Keywords: نقص نقطه; Sintering; Planar defects; Point defects; Grain growth; Electrical properties;
Edge dislocations as sinks for sub-nanometric radiation induced defects in α-iron
Keywords: نقص نقطه; Point defects; Edge dislocation; Defect interaction; Radiation damage; Atomic simulation;
Multisite formation in gadolinium doped SrF2 nanoparticles
Keywords: نقص نقطه; Nanostructured materials; Point defects; Gadolinium; Electron paramagnetic resonance; Optical spectroscopy; Site-selective spectroscopy;
Synthesis of ZnO nanoparticles by co-precipitation method for solar driven photodegradation of Congo red dye at different pH
Keywords: نقص نقطه; ZnO nanoparticles; Point defects; Photocatalytic;
Description of phase transitions through accumulation of point defects: UN, UO2 and UC
Keywords: نقص نقطه; Uranium dioxide; Uranium mononitride; Uranium monocarbide; Phase transition; Point defects; Molecular dynamics;
Effects of point defects on the mechanical response of LaRu2P2
Keywords: نقص نقطه; LaRu2P2; Point defects; Superelastic; Pseudo-elastic; ThCr2Si2; Structure; DFT;
As-vacancy complex in Zn-diffused GaAs: Positron lifetime spectroscopy study
Keywords: نقص نقطه; Positron annihilation spectroscopy; Point defects; Diffusion; Compound semiconductors;
Regular articleDiffusion of point defects near stacking faults in 3C-SiC via first-principles calculations
Keywords: نقص نقطه; Stacking faults; Point defects; First-principles calculations; Diffusion; Silicon carbide;
Point defect properties of ternary fcc Fe-Cr-Ni alloys
Keywords: نقص نقطه; Density functional theory; Fe-Cr-Ni alloys; Point defects; Short-range order;
Density functional theory study of defects in unalloyed δ-Pu
Keywords: نقص نقطه; Density functional theory; Delta-plutonium; Point defects; Complex defects;
Evolution of irradiation-induced strain in an equiatomic NiFe alloy
Keywords: نقص نقطه; Molecular dynamics; X-ray diffraction (XRD); Nickel alloys; Point defects; Strain relaxation;
Theoretical study of deposition-induced point defects in ZnO
Keywords: نقص نقطه; ZnO; Point defects; Density functional theory;
Effect of doping concentration on point defect structure in As-implanted ZnO
Keywords: نقص نقطه; P-type ZnO; Ion implantation; Diffuse x-ray scattering; Point defects;
Impact of glass density on the green emission and NBOHC formation in silica glass: A combined high pressure and 2.5Â MeV electron irradiation
Keywords: نقص نقطه; Point defects; Silica glass; Luminescence; High pressure; Irradiation;
Modeling of fluorine atoms interaction with the fluorinated diamond С(100)-(2 Ã 1) surface
Keywords: نقص نقطه; C(100)-(2Â ÃÂ 1) diamond surface; Quantum-chemical modeling; Point defects; Adsorption; Chemical etching; Mono- and difluoride states;
Native point defects in Ti3GeC2 and Ti2GeC
Keywords: نقص نقطه; Density functional theory; MAX phase; Phonon dispersion; Point defects;
Influence of point defects on optical properties of GaN-based materials by first principle study
Keywords: نقص نقطه; GaN-based materials; Point defects; First principle; Exciton; Yellow luminescence;
Nonstoichiometry and luminescent properties of ZnSe crystals grown from the melt at high pressures
Keywords: نقص نقطه; Point defects; Impurities; Growth from melt; Semiconducting II-VI materials;
Microstructure and impedance properties of La, Ce multi-rare earth ions doped Na0.5Bi2.5Nb2O9 Aurivillius type ceramics
Keywords: نقص نقطه; Ceramics; Solid state reaction; Electrical transport; Dielectric response; Microstructure; Point defects;
Thermally-activated anelastic relaxation in a high-manganese Cu-Mn alloy studied by isothermal low-frequency internal friction
Keywords: نقص نقطه; Manganese-rich copper-manganese alloy; Isothermal internal friction; Point defects; Dislocations;
Effects of the implantation of Sn ions in W; chemical state, crystal structure and hardness
Keywords: نقص نقطه; Tin; Tungsten; Ion implantation; Point defects; Chemical shift;
New scheme for calculating the kinetic coefficients in CdTe based on first-principle wave function
Keywords: نقص نقطه; Semiconductors; Electron transport; Point defects; DFT wavefunction;
Interaction of Ti and Cr atoms with point defects in bcc vanadium: A DFT study
Keywords: نقص نقطه; DFT; Vanadium-titanium-chromium; Point defects; Titanium-vacancy complexes; Swelling;
Reduction of point defects and Cu surface composition in Cu(In,Ga)Se2 film by Se annealing with a NaF overlayer at intermediate temperatures
Keywords: نقص نقطه; Cu(In,Ga)Se2; Point defects; NaF overlayer; Cu concentration; Valence band maximum;
Radiation damage in gallium-stabilized δ-plutonium with helium bubbles
Keywords: نقص نقطه; Radiation damage; Plutonium; Point defects; Helium bubbles; Molecular dynamics;
Fabrication of Nb-doped ZnO nanowall structure by RF magnetron sputter for enhanced gas-sensing properties
Keywords: نقص نقطه; Transition metal alloys and compounds; Nanostructured compounds; Nanofabrications; Surfaces and interfaces; Point defects; X-ray diffraction;