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- W1985706713 abstract "Abstract The structural, elastic and electronic properties of ordered face-centered cubic (L1 2 ) γ′-Ni 3 Ti were studied using the projector-augmented-wave (PAW) method within the generalized gradient approximation (GGA). The fact that the elastic constants meet the requirements of mechanical stability for a cubic crystal indicates that γ′-Ni 3 Ti is mechanically stable at 0 K. The bulk modulus, shear modulus, Young's modulus and Poisson's ratio are estimated from the calculated elastic constants of single crystal. The ratio of the bulk modulus to shear modulus ( B / G ) is 2.00 and the material is ductile. Through the quasi-harmonic Debye model, the pressure and temperature dependences of the linear expansion coefficient, bulk modulus, the Debye temperature and heat capacity have been investigated for the first time." @default.
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- W1985706713 date "2013-03-01" @default.
- W1985706713 modified "2023-10-16" @default.
- W1985706713 title "First-principles studies of the structural, elastic, electronic and thermal properties of γ′-Ni3Ti" @default.
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- W1985706713 doi "https://doi.org/10.1016/j.physb.2012.12.020" @default.
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