scholarly journals Phonon Dynamics and Acoustic and Thermodynamic Properties of Pt57.5Cu14.7Ni5.3P22.5 Bulk Metallic Glass

2021 ◽  
Vol 13 (1) ◽  
pp. 21-29
Author(s):  
R. R. Koireng ◽  
P. C. Agarwal ◽  
A. Gokhroo

The phonon dispersion curves for Pt57.5Cu14.7Ni5.3P22.5 bulk metallic glass (BMG) are computed employing various dielectric screenings using the simple model given by Bhatia and Singh. The force constants β and δ for computing the dispersion curves are calculated from the elastic constants i.e. bulk modulus (B) and shear modulus (G) along with the calculated value of force constant κe of the material of the glass for the first time. The results of the phonon dispersion curves show appropriate behavior in the long wavelength region in detail for both the longitudinal and transverse modes and give insight regarding the acoustic and thermal properties of the BMG. The transverse sound velocity and the longitudinal velocities with various dielectric screening are calculated from the dispersion curves in the long wavelength region. The corresponding thermodynamic property (Debye temperature) is calculated for different dielectric screenings. The theoretical results predicted are in a good agreement with the reported data in the literature for the Pt57.5Cu14.7Ni5.3P22.5 BMG and may be used for correlating other properties.

2009 ◽  
Vol 1 (2) ◽  
pp. 182-191 ◽  
Author(s):  
M. A. Hossain ◽  
A.K.M. A Islam ◽  
F. N. Islam

Investigations of elastic properties of Li3N in both α- and β-phases have been made by first-principles methods (HF-LCAO, DFT as implemented in CRYSTAL98 and in CASTEP). The theoretical equation of state of the α-phase (D46h structure) produced by our total-energy calculations is compared with the experimental EOS. Five independent elastic constants are calculated for the first time for both the phases. These are compared with the available four elastic constants of α-Li3N estimated from the slopes of the acoustic branches in the long wavelength region of the measured phonon dispersion curves. The aggregate elastic moduli (B, G, E), the Poisson’s ratio (ν) and the Debye temperature ΘD as a function of pressure are also calculated and the results discussed.Keywords: Li3N; α- and β-phases; Elastic properties; Debye temperature.©?2009 JSR Publications. ISSN: 2070-0237 (Print); 2070-0245 (Online). All rights reserved.DOI: 10.3329/jsr.v1i2.1763     


2004 ◽  
Vol 93 (17) ◽  
Author(s):  
H. Yanagisawa ◽  
T. Tanaka ◽  
Y. Ishida ◽  
M. Matsue ◽  
E. Rokuta ◽  
...  

1992 ◽  
Vol 8 (1-3) ◽  
pp. 433-435 ◽  
Author(s):  
E. V. Jakovenko ◽  
A. F. Goncharov ◽  
S. M. Stishov

2006 ◽  
Vol 74 (3) ◽  
Author(s):  
J. Lobo ◽  
D. Farías ◽  
E. Hulpke ◽  
J. P. Toennies ◽  
E. G. Michel

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