Keywords: طول پیوند; Strain-Hardening Cementitious Composite; High tensile strength; Steel corrosion; Structural repair; Bond length;
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Chemistry is about energy and its changes: A critique of bond-length/bond-strength correlations
Keywords: طول پیوند; Badger's rule; Bond dissociation energy; Bond length; Chemical bond; Force constants;
Keywords: طول پیوند; Chemical hardness; Bond length; Bond force constant; DFT; A new molecular hardness equation
Keywords: طول پیوند; Bond order; Bond length; Bond angle; Electron density topology; Thermal decomposition of copper and silver oxalates
Keywords: طول پیوند; Quintuple bond; Group VI metals; Supporting ligands; Bond length; Reactivity
Keywords: طول پیوند; Probability distribution; Phase space; Bond length; Fermi-Pasta-Ulam chain;
Keywords: طول پیوند; Carbon nanotube; Optical absorption; Density functional theory; Curvature; Bond length;
Research on the thermal expansion of AgGa1âxInxSe2 single crystals
Keywords: طول پیوند; AgGa1âxInxSe2; Crystal growth; Thermal expansion anisotropy; Bond length; Thermal vibration;
Chemical shift in Lα, Lβ1, Lβ3,4, Lβ2,15, Lγ1 and Lγ2,3 emission lines of 47Ag, 48Cd and 50Sn compounds
Keywords: طول پیوند; L emission lines; Chemical effect; Theoretical methods; Bond length; Relative line-width; CK process; Effective charge and WDXRF;
Structural, electrical, optical and dielectric properties of sol-gel derived (1Â â x) BiFeO3 - (x) Pb(Zr0.52Ti0.48)O3 novel multiferroics materials
Keywords: طول پیوند; Multiferroics; Blue shift; Rietveld refinement; Bond length; Magnetoelectric couplings;
Electronic and optical properties of cubic SrHfO3 at different pressures: A first principles study
Keywords: طول پیوند; GGA; Pressure; Bond length; Hybridization; Energy band gap; Dielectric;
The Gaussian distribution of lattice size and atomic level heterogeneity in high entropy alloys
Keywords: طول پیوند; High entropy alloys; Gaussian distribution; Stacking fault energy; Bond length; Heterogeneity;
Photoluminescence quenching and enhanced spin relaxation in Fe doped ZnO nanoparticles
Keywords: طول پیوند; Fe doped ZnO; Bond length; Photoluminescence; Specific spin relaxation rate;
Crystal structure details of La- and Bi-substituted hydroxyapatites: Evidence for LaO+ and BiO+ with a very short metal-oxygen bond
Keywords: طول پیوند; Apatite; Structure elucidation; Lanthanum; Bismuth; Bond length;
Structural, bonding, anisotropic mechanical and thermal properties of Al4SiC4 and Al4Si2C5 by first-principles investigations
Keywords: طول پیوند; Bond length; Anisotropy; Heat capacity
Structural, transport and ferroelectric properties of Zn1−xMgxO samples and their local electronic structure
Keywords: طول پیوند; Zinc oxide; Rietveld refinement; Bond length; Polarization and X-ray absorption spectroscopy
Microstructures and microwave dielectric properties of (1 − x)(Sr0.4Na0.3La0.3)TiO3–xLnAlO3 (Ln = Sm, Nd) ceramic systems
Keywords: طول پیوند; (Sr0.4Na0.3La0.3)TiO3; LnAlO3; Perovskites; Polarizability; Bond length
A DFT investigation on the electronic properties of octahaloditechnetate anions: Correlation between charge and bond strength
Keywords: طول پیوند; Octahalodimetalate anions; Multiple metal-metal bonds; Bond order; Bond length; DFT calculations; NBO analyses;
Experimental investigation of the bond behavior of the interface between near-surface-mounted CFRP strips and concrete
Keywords: طول پیوند; Near-surface-mounted; Bond behavior; CFRP strips; Interface debonding; Bond length
Effect of bond length on the behaviour of CFRP strengthened concrete-filled steel tubes under transverse impact
Keywords: طول پیوند; CFRP; Concrete-filled steel tubular (CFST) columns; Transverse impact; Bond length; Numerical models
Compositional effects on Si–OH bond length in hydrous silicates with implications for trends in the SiOH acidity
Keywords: طول پیوند; Hydrogen silicate; Bond length; Brønsted acidity; Silanol group; Silica acidity
Effect of transition metal (M) and M–C slabs on equilibrium properties of Al-containing MAX carbides: An ab initio study
Keywords: طول پیوند; MAX phases; Bond length; Bond angle; Carbides; First-principle
Spectroscopic and electrochemical characterization of some Schiff base metal complexes containing benzoin moiety
Keywords: طول پیوند; Schiff bases; Chelates; Bond length; Racha parameters; Electrode mechanism; Thin layer voltammetry;
Experimental investigation of a bond-type anchorage system for multiple FRP tendons
Keywords: طول پیوند; FRP (Fiber-Reinforced Polymer); Anchorage; RPC (Reactive Powder Concrete); Multi-rod system; Non-uniformity; Capacity reduction; Bond stress; Bond length;
Bond lengths in organometallic and coordination complexes: Substituent effects
Keywords: طول پیوند; Bond length; Complexes; Inductive effect; Conjugation; Steric effect; Polarizability effect
X-ray absorption and Raman study of GaN films grown on different substrates by different techniques
Keywords: طول پیوند; GaN; Raman scattering; X-ray absorption; Bond length; Strain
Ab initio potentials for states of XeI, XeIâ and XeI+
Keywords: طول پیوند; Xenon; Iodine; Noble gas monohalide; Excimer; Coupled clusters; Multireference; Average coupled-pair functional; Configuration interaction; Spin-orbit coupling; Charge transfer; Relativistic effective core potential; Correlation-consistent basis set; Io
Bond length variations: Electron number profiles and transferable atomic sizes
Keywords: طول پیوند; B3LYP; DFT; Bond length; Diatomic molecule; Bond-stretch isomer
A Simple Theoretical Model for Ring and Nanotube Radial Breathing Mode
Keywords: طول پیوند; Radial breathing mode; Diameter; Ring; Nanotubes; Bond length;
Polyacenes electronic properties and their dependence on molecular size
Keywords: طول پیوند; Polyacene; Total electronic energy; Atomization energy; Polarizability; Rotational constant; Bond length; Linear relation; Group additivity; Theoretical calculation;
The accuracy of molecular bond lengths computed by multireference electronic structure methods
Keywords: طول پیوند; Bond length; Multiconfiguration self-consistent field; Multiference; Configuration interaction; Complete basis set limit; MCSCF; MR-SDCI; MR-AQCC; Re; CBS; GVB;
On the determination of bond lengths by ab-initio methods II: Simplifications and new considerations
Keywords: طول پیوند; Bond length; ab-initio methods; Semiempirical methods; B3LYP; Moeller-Plesset; INDO; Molecular geometry;
DFT/B3LYP study of O-H bond dissociation enthalpies of para and meta substituted phenols: Correlation with the phenolic C-O bond length
Keywords: طول پیوند; BDE; DFT; Phenol; Antioxidant; Bond length; Hydrogen atom transfer;
Electronic structure, energetics and geometric structure of carbon nanotubes: A density-functional study
Keywords: طول پیوند; 61.82.Ms; 71.35.ây; 78.55.Hx; Carbon nanotube; Density of states; Bond length; Bond angle; Density-functional theory;
Counterion effects on the cation-Ï interactions between alkaline earth cations and pyrrole
Keywords: طول پیوند; Interaction energy; Bond length; Cation;
An ab initio study of the use of Ag2â for catalytic oxidation of CO
Keywords: طول پیوند; 36.40.-c; 71.20.Be; 82.65.+r; Catalytic oxidation; Gold clusters; Bond length;
Are values of parameters describing magnetic properties of crystal really fixed?
Keywords: طول پیوند; Lattice parameter; Bond length; Free-carrier concentration; Superexchange; Heisenberg model; Exchange integrals; Diluted magnetic semiconductors; Ga1âxMnxAs; Zn1âxMnxTe;