ELATE: Elastic tensor analysis
Welcome to ELATE, the online tool for analysis of elastic tensors, developed by Romain Gaillac and François-Xavier Coudert at CNRS / Chimie
ParisTech.
If you use the software in published results (paper, conference, etc.), please cite the corresponding paper (J. Phys. Condens. Matter, 2016, 28, 275201) and give the
website URL.
ELATE is open source software. Any queries or comments are welcome at
Summary of the properties
Input: stiffness matrix (coefficients in GPa) of Li3P7 (Materials Project id mp-28336)
36 16 19 0 0 0 16 34 17 0 0 0 19 17 47 0 0 0 0 0 0 11 0 0 0 0 0 0 16 0 0 0 0 0 0 11
Average properties
Averaging scheme | Bulk modulus | Young's modulus | Shear modulus | Poisson's ratio |
---|---|---|---|---|
Voigt | KV = 24.556 GPa | EV = 30.809 GPa | GV = 11.933 GPa | νV = 0.29089 |
Reuss | KR = 23.921 GPa | ER = 29.775 GPa | GR = 11.518 GPa | νR = 0.29254 |
Hill | KH = 24.238 GPa | EH = 30.292 GPa | GH = 11.726 GPa | νH = 0.2917 |
Eigenvalues of the stiffness matrix
λ1 | λ2 | λ3 | λ4 | λ5 | λ6 |
---|---|---|---|---|---|
11 GPa | 11 GPa | 16 GPa | 18.92 GPa | 23.494 GPa | 74.586 GPa |
Variations of the elastic moduli
Young's modulus | Linear compressibility | Shear modulus | Poisson's ratio | Emin | Emax | βmin | βmax | Gmin | Gmax | νmin | νmax |
---|---|---|---|---|---|---|---|---|---|
Value | 24.909 GPa | 38.118 GPa | 8.6264 TPa–1 | 17.916 TPa–1 | 9.478 GPa | 16 GPa | 0.14993 | 0.40956 | Value |
Anisotropy | 1.53 | 2.0769 | 1.688 | 2.7318 | Anisotropy | ||||
Axis | 0.0000 1.0000 0.0000 |
0.5666 0.0000 0.8240 |
0.0000 0.0000 1.0000 |
0.0000 1.0000 0.0000 |
-0.7071 0.7071 -0.0000 |
0.0000 0.0000 1.0000 |
0.7291 -0.0003 0.6845 |
-0.6900 0.0000 -0.7238 |
Axis |
-0.7071 -0.7071 -0.0000 |
-1.0000 0.0000 0.0000 |
0.6845 -0.0006 -0.7291 |
-0.0000 -1.0000 -0.0000 |
Second axis |
Spatial dependence of Young's modulus
Young's modulus in (xy) plane
Young's modulus in (xz) plane
Young's modulus in (yz) plane
Spatial dependence of linear compressibility
linear compressibility in (xy) plane
linear compressibility in (xz) plane
linear compressibility in (yz) plane
Spatial dependence of shear modulus
Shear modulus in (xy) plane
Shear modulus in (xz) plane
Shear modulus in (yz) plane
Spatial dependence of Poisson's ratio
Poisson's ratio in (xy) plane
Poisson's ratio in (xz) plane
Poisson's ratio in (yz) plane