Keywords: طیف نوری; Colour; Crystal structure; EPR; Optical spectra; V4+;
مقالات ISI طیف نوری (ترجمه نشده)
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Keywords: طیف نوری; Graphene; First-principles; Defects; Thermal properties; Optical spectra; Specific heat;
Keywords: طیف نوری; Charge order; Optical spectra; Photo-excitation
Keywords: طیف نوری; Organic dyes; Dye-sensitized solar cells; Optical spectra; TDDFT calculations; Fluorene; Donor-acceptor compounds;
Keywords: طیف نوری; Colquiriite-type fluorides; Optical spectra; Electron paramagnetic resonance; Crystal- and ligand-field theory; Cr3+
Study of Mn2+ luminescence in β-PbF2
Keywords: طیف نوری; Mn2+; Exchange-coupled pair; Crystal field; Striction; Fluorite; Optical spectra; Photoluminescence;
Investigations of the optical and EPR data and local structure for the trigonal tetrahedral Co2+ centers in LiGa5O8: Co2+ crystal
Keywords: طیف نوری; Optical spectra; Electron paramagnetic resonance; Crystal- and ligand-field theory; Co2+; LiGa5O8;
First-principles optical spectra for the oxygen vacancy in YAlO3 crystal
Keywords: طیف نوری; Oxygen vacancy; Density functional theory; Band edge problem; FNV alignment; Optical spectra;
Optical spectra of composite silver-porous silicon (Ag-pSi) nanostructure based periodical lattice
Keywords: طیف نوری; Porous silicon; Silver; Periodical lattice; Optical spectra; FDTD lumerical solutions;
Cation modified A2(Ba, Sr and Ca) ZnWO6 cubic double perovskites: A theoretical study
Keywords: طیف نوری; Density functional theory; Double perovskite; Band structure; Density of states; Dielectric constant; Reflectivity; Optical spectra;
Photooxidation of DNA as a key step in the cytotoxicity of photochromic diarylethenes
Keywords: طیف نوری; Photoactivatable drugs; DNA intercalators; Optical spectra; Molecular dynamics; Ab initio simulations;
Exploring the excited-states of squaraine dyes with TD-DFT, SOS-CIS(D) and ADC(2)
Keywords: طیف نوری; Optical spectra; Cyanine dyes; Ab initio calculations; TD-DFT; Fluorescence;
Ca2GeO4:Cr4Â + transparent nano-glass ceramics
Keywords: طیف نوری; Phase diagrams; Glass-ceramics; Cr4Â +:Ca2GeO4 nanophase; Optical spectra;
Spectroscopic properties of Eu3+ complex with 2-hydroxy-4-metoxy-benzophenone - IR, Raman, DFT calculations and femtosecond laser excited luminescence
Keywords: طیف نوری; Eu3+ complex; 2 hydroxy-4-metoxy-benzophenone; FT-IR and FT-Raman; DFT calculations; Optical spectra; Femtosecond laser excitation;
Simulation of natural dyes adsorbed on TiO2 for photovoltaic applications
Keywords: طیف نوری; Dye-sensitized solar cell; Optical spectra; TD-DFT;
Vibronics in optical spectra of Yb3+ and Ce3+ in YAG and Y2O3 ceramics
Keywords: طیف نوری; Yb3+ and Ce3+; Optical spectra; YAG and Y2O3 transparent ceramics; Electron-phonon interaction; Vibronic lines;
Theoretical analysis of electron vibration interactions and study of photo physical properties in Ce3+ doped Ca2P2O7 nano phosphor capped with SHMP
Keywords: طیف نوری; Photoluminescence; Capping; Nano phosphor; Rare earth; Optical spectra; Electron vibration interaction;
Elastic properties and optical spectra of ZnS1âxOx dilute semiconductor alloys
Keywords: طیف نوری; Elastic properties; Optical spectra; Dilute semiconductor alloys; Ab initio calculations; Materials for solar cells;
Recombination processes in lanthanum beryllate single crystals doped with Ce3+ and Pr3+ ions
Keywords: طیف نوری; Optical spectra; X-ray luminescence; Thermoluminescence; Lanthanum beryllate crystal; La2Be2O5
Synthesis and photovoltaic properties of organic photosensitizer using D-π-D type 4, 5-diazafluorene ligand and derivatives for efficient dye-sensitized solar cell
Keywords: طیف نوری; Dye-sensitized solar cell; Optical spectra; 4,5-Diazafluorene; Photovoltaic; Zinc and ruthenium complex
Synthesis and characterization of thieno[3,4-d]imidazole-based organic sensitizers for photoelectrochemical cells
Keywords: طیف نوری; Thieno[3,4-d]imidazole; Organic dyes; Optical spectra; TDDFT computations; Dye-sensitized solar cells; Electrochemical impedance spectra
Optical properties of V-shaped bis-coumarins: Ab initio insights
Keywords: طیف نوری; Coumarin dyes; Optical spectra; TD-DFT; CC2; ADC(2);
Assignments of the optical band positions and theoretical calculations of the spin-Hamiltonian parameters for the tetragonal W5+ octahedral clusters in tungsten oxide (WO3)-based glasses
Keywords: طیف نوری; WO3-based glasses; Electron paramagnetic resonance; Optical spectra; Crystal- and ligand-field theory; W5+
Comparative study on optical properties of Yb3+ doped LiNbO3: MgO and LiNbO3:ZnO laser crystals
Keywords: طیف نوری; Yb3+ doped LiNbO3:MgO; Yb3+ doped LiNbO3:ZnO; Optical spectra; Comparative study; Laser material;
Synthesis of Ï-A-porphyrins and their photoelectric performance for dye-sensitized solar cells
Keywords: طیف نوری; Ï-A-porphyrin; DSSC; Optical spectra; Photovoltaic performance; Electrochemical property;
Studies on potential use of tin(IV) porphyrin in a role of proteins’ label
Keywords: طیف نوری; Label; Metalloporphyrin; Affinity biosensor; Voltammetry; Optical spectra
The covalent effect on the energy levels of d3d3 ions in tetragonal compounds
Keywords: طیف نوری; Covalence effect; Optical spectra; Tetragonal; Cobalt; Semiconducting compounds
Synthesis and photovoltaic properties of organic dyes containing N-fluoren-2-yl dithieno[3,2-b:2â²,3â²-d]pyrrole and different donors
Keywords: طیف نوری; Organic dyes; Dye-sensitized solar cells; Optical spectra; Theoretical calculations; Dithienopyrrole; Fluorene;
Electronic structure and spectroscopic properties of (2S,3S)-2,3-diphenyl-5,6-diheteroaryl-2,3-dihydropyrazines and their model oligomers
Keywords: طیف نوری; TD-B3LYP calculations; Neutral and charged states; 2,3-Dihydropyrazines; Synthesis; Optical spectra
Optoelectronic properties of cubic BxInyGa1âxâyN alloys matched to GaN for designing quantum well Lasers: First-principles study within mBJ exchange potential
Keywords: طیف نوری; BInGaN alloys; QW Lasers; FP-LAPW; mBJ potential; Electronic structure; Optical spectra;
Theoretical studies of the optical and EPR spectra for VO2+ in MgKPO4·6H2O single crystal
Keywords: طیف نوری; Electron paramagnetic resonance (EPR); Optical spectra; MgKPO4·6H2O; VO2+
Optical Spectra and Gain Properties of Ho3+/Pr3+ Co-doped LiYF4 Crystal
Keywords: طیف نوری; LiYF4 crystal; 2.9 μm; Ho3/Pr3+; Optical spectra; Gain cross section;
Modelling solvent effects on the absorption and emission spectra of constrained cyanines with both implicit and explicit QM/EFP models
Keywords: طیف نوری; BODIPY dyes; Solvatochromism; Optical spectra; TD-DFT; EFP;
The covalent effect on the energy levels of d2 ions in tetragonal crystal
Keywords: طیف نوری; Covalence effect; Vanadium; Optical Spectra; Gallium phosphide; Tetragonal;
The excited state behavior of cytosine in the gas phase: A TD-DFT study
Keywords: طیف نوری; DNA; Optical spectra; Excited states; TD-DFT;
OptaDOS: A tool for obtaining density of states, core-level and optical spectra from electronic structure codes
Keywords: طیف نوری; Electronic structure; Density-functional theory; Density of states; EELS; Optical spectra
Electronic and optical properties of the SiB2O4 (B=Mg, Zn, and Cd) spinel oxides: An ab initio study with the Tran–Blaha-modified Becke–Johnson density functional
Keywords: طیف نوری; Oxides; Ab initio calculations; Electronic properties; Optical spectra
The covalence effect of energy levels of ZnS:Mn2+
Keywords: طیف نوری; Covalence effect; II-VI Semiconductors; Optical spectra; Zinc sulfide; Manganese;
Effect of gamma radiation on ultraviolet, visible and infrared studies of NiO, Cr2O3 and Fe2O3-doped alkali borate glasses
Keywords: طیف نوری; Alkali borate glasses; Combined transition metal; Optical spectra; Gamma irradiation;
Lattice properties, energy states and optical spectra of MnxGa1âxAs magnetic semiconductors
Keywords: طیف نوری; Structural properties; Band structure; Optical spectra; Magnetic semiconductors; MnxGa1âxAs;
Optical and photoelectron spectroscopy studies of KPb2Cl5 and RbPb2Cl5 laser crystals
Keywords: طیف نوری; Double alkali-lead halides; Optical spectra; Electronic structure; Photoelectron spectra
Spectroscopic study of red-light-emitting centers in K2Al2B2O7: Fe single crystals
Keywords: طیف نوری; Luminescence; Optical spectra; Temperature dependence; Impurity defects; KABO
Spectral signatures of thieno[3,4-b]pyrazines: Theoretical interpretations and design of improved structures
Keywords: طیف نوری; Thienopyrazine; Optical spectra; Push–pull dyes; Oligothiophene; TD-DFT; Ab initio investigations
DNA-directed self-assembly and optical properties of discrete 1D, 2D and 3D plasmonic structures
Keywords: طیف نوری; Plasmonics; DNA; Self-assembly; Optical spectra; Resonances; Superstructures; Nanocrystals
Investigations of g factors for the 2E state of V2+ ions in Al2O3 crystals
Keywords: طیف نوری; Optical spectra; Al2O3 crystals; Exchange charge model; g Factors;
Theoretical investigations of optical spectra and electron paramagnetic resonance spectra of LiCl:Ni2+ crystals
Keywords: طیف نوری; Optical spectra; Electron paramagnetic resonance (EPR); Charge transfer mechanism; Local structure; Ni2+;
Growth and characterization of Nd:Bi12SiO20 single crystal
Keywords: طیف نوری; Nd:Bi12SiO20 crystal; Thermal properties; Optical spectra; Laser diode pumped
A combined experimental and theoretical study of natural betalain pigments used in dye-sensitized solar cells
Keywords: طیف نوری; Dye-sensitized solar cells; Betalains; Nanocrystalline TiO2; Photovoltaic conversion efficiency; Time-dependent density functional theory; Optical spectra
Fluorene-based organic dyes containing acetylene linkage for dye-sensitized solar cells
Keywords: طیف نوری; Organic dyes; Dye-sensitized solar cells; Optical spectra; TDDFT calculations; Fluorene; Acetylene
Effect of alkali metal oxides on the properties of radio-photoluminescence glasses
Keywords: طیف نوری; Radio-photoluminescence glass; Silver-doped; Alkali ions; Fluorescence spectra; Optical spectra;