首页|Effect of defectiveness of carbon sublattice on elastic properties and microstrains of disordered cubic tantalum carbide TaCy

Effect of defectiveness of carbon sublattice on elastic properties and microstrains of disordered cubic tantalum carbide TaCy

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  • NSTL
  • Elsevier
Changes in the elastic constants c(ij) of disordered cubic TaCy tantalum carbide with an increasing the defectiveness of the carbon sublattice are estimated for the first time. The deviation of tantalum carbide from the stoichiometric composition TaC1.0 leads to a decrease in the elastic stiffness constants c(ij) of disordered TaCy carbide with a simultaneous increase in elastic anisotropy. The distributions of the Young's modulus E and the Poisson's ratio mu in the (100) plane and the distributions of the shear modulus G in the (100), (110), and (111) planes have been calculated as functions on the crystallographic direction [hkl] and on the relative carbon content y in TaCy carbide. The Vickers hardness H-V of disordered tantalum carbide was calculated using the inverse Pugh's ratio G/B and the experimental data on the dependences of the bulk modulus B and the shear modulus G on the composition of disordered TaCy . Influence of nonstoichiometry of nanocrystalline powders of cubic tantalum carbide TaCy on anisotropy of strain distortions is established. The value of microstrains epsilon(hkl) is estimated with allowance for their anisotropy.

Disordered tantalum carbideNonstoichiometryVacanciesElastic propertiesHardnessStrain distortionsTOTAL-ENERGY CALCULATIONSMECHANICAL-PROPERTIES1ST PRINCIPLESPARTICLE-SIZETRANSITIONNONSTOICHIOMETRYDIFFRACTIONMICROSTRUCTUREDENSIFICATIONANISOTROPY

Gusev, Aleksandr, I

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Russian Acad Sci

2022

10.1016/j.ijrmhm.2021.105760

International Journal of Refractory Metals & Hard Materials

International Journal of Refractory Metals & Hard Materials

SCI
ISSN：0263-4368
年,卷(期)：2022.103
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