Calculation of all cubic single-crystal elastic constants from single atomistic simulation: Hydrogen effect and elastic constants of nickel

2011 ◽  
Vol 182 (8) ◽  
pp. 1621-1625 ◽  
Author(s):  
M. Wen ◽  
A. Barnoush ◽  
K. Yokogawa
Keyword(s):  
Single Crystal ◽  
Elastic Constants ◽  
Atomistic Simulation ◽  
Hydrogen Effect

scholarly journals Generalization of intrinsic ductile-to-brittle criteria by Pugh and Pettifor for materials with a cubic crystal structure

2021 ◽  
Vol 11 (1) ◽  
Author(s):  
O. N. Senkov ◽  
D. B. Miracle
Keyword(s):  
Crystal Structure ◽  
Shear Modulus ◽  
Bulk Modulus ◽  
Single Crystal ◽  
Elastic Constants ◽  
Mechanical Analysis ◽  
Quantum Mechanical ◽  
Modulus Ratio ◽  
Cubic Crystal ◽  
The Difference

AbstractTwo classical criteria, by Pugh and Pettifor, have been widely used by metallurgists to predict whether a material will be brittle or ductile. A phenomenological correlation by Pugh between metal brittleness and its shear modulus to bulk modulus ratio was established more than 60 years ago. Nearly four decades later Pettifor conducted a quantum mechanical analysis of bond hybridization in a series of intermetallics and derived a separate ductility criterion based on the difference between two single-crystal elastic constants, C12–C44. In this paper, we discover the link between these two criteria and show that they are identical for materials with cubic crystal structures.

DECcalc - A Program for the Calculation of Diffraction Elastic Constants from Single Crystal Coefficients

2011 ◽  
Vol 681 ◽  
pp. 417-419 ◽  
Author(s):  
Thorsten Manns ◽  
Berthold Scholtes
Keyword(s):  
Computer Program ◽  
Single Crystal ◽  
Elastic Constants ◽  
Single Phase ◽  
Proper Function ◽  
Almost All

A Matlab based computer program was developed which gives the possibility to calculate the diffraction elastic constants (DEC) of macroscopically isotropic, single phase materials from their single crystal elastic constants. The proper function of the program was confirmed by means of results from literature. In almost all cases the results from the program DECcalc could reproduce the values and diagrams given in the appropriate publications. Discrepancies could always be assigned to the use of different single crystal coefficients.

scholarly journals Estimation of 8th, 10th and 12th Order ODF Coefficients From Elastic Properties in Cold Rolled Steel Sheets by Adjustment of Single Crystal Elastic Constants

1990 ◽  
Vol 12 (1-3) ◽  
pp. 175-185 ◽  
Author(s):  
Kei Sakata ◽  
Dominique Daniel ◽  
John J. Jonas
Keyword(s):  
Single Crystal ◽  
Elastic Constants ◽  
Elastic Energy ◽  
X Rays ◽  
Rolled Steel ◽  
Steel Sheets ◽  
Fitting Procedure ◽  
Pole Figures ◽  
Cold Rolled ◽  
Fiber Components

In an earlier paper (Sakata et al., 1989), it was shown that the 4th and 6th order ODF coefficients could be successfully derived from Young's modulus measurements using the elastic energy method. However, the values of some of the coefficients fell beyond the expected error ranges. In this study, more appropriate single crystal elastic constants are selected by means of a fitting procedure. Then the ODF coefficients are again estimated in the manner described previously. As a result, the values of the C411, C611, C612 and C614 coeffioents, which were somewhat inaccurate in the previous calculation, are improved considerably. The volume fractions of the principal preferred orientations are then employed to predict the 8th order coefficients and the fiber components of the l = 10 and l = 12 (C1011, C1211 and C1221) coefficients. With the aid of the coefficients obtained in this way, both pole and inverse pole figures are drawn, which are in better agreement with those based on X-rays than when only the 4th order coefficients are employed.

Elastic Constants of Single‐Crystal Mo and W between 77° and 500°K

1962 ◽  
Vol 33 (7) ◽  
pp. 2311-2314 ◽  
Author(s):  
D. I. Bolef ◽  
J. De Klerk
Keyword(s):  
Single Crystal ◽  
Elastic Constants

scholarly journals Single Crystal Elastic Constants of TWIP Steel Determined From Nanoindentation

2013 ◽  
Vol 19 (S2) ◽  
pp. 1052-1053 ◽  
Author(s):  
D.T. Pierce ◽  
K. Nowag ◽  
A. Montagne ◽  
J.A. Jimenez ◽  
J.E. Wittig ◽  
...  
Keyword(s):  
Single Crystal ◽  
Elastic Constants ◽  
Twip Steel

Extended abstract of a paper presented at Microscopy and Microanalysis 2013 in Indianapolis, Indiana, USA, August 4 – August 8, 2013.

Elastic Constants in C-plane of Single Crystal Bi 2Sr 2Ca Cu 208 between 80 K and 260 K

1990 ◽  
Vol 193 ◽  
Author(s):  
Jin Wu ◽  
Yening Wang ◽  
Yifeng Yan ◽  
Zhongxian Zhao
Keyword(s):  
Shear Modulus ◽  
Single Crystal ◽  
Temperature Dependence ◽  
Elastic Constants ◽  
Wide Temperature Range ◽  
Sound Propagation ◽  
Anisotropic Elasticity ◽  
Ultrasonic Velocities ◽  
Temperature Range

ABSTRACTThe temperature dependence of the in-plane C11 C22. C12 and C66 modes between 80 and 260 K of superconducting crystals of Bi2Sr2Ca1Cu208 have been obtained via the measurements of ultrasonic-velocities. The anisotropic elasticity in the a-b plane of single crystal Bi2 Sr2Ca1Cu2O8 is manifest. The shear modulus of sound propagation along the [110] with the polarization has been also calculated and shows an overall trend of softening over a wide temperature range above Tc. The shear modulus C6 6 shows three obvious softening minima around 240–250 K, 150 K and 100 K.

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