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 SrTiO3 (Materials Project id mp-4651)
297 83 112 0 0 0 83 297 112 0 0 0 112 112 311 0 0 0 0 0 0 102 0 0 0 0 0 0 102 0 0 0 0 0 0 108
Average properties
Averaging scheme | Bulk modulus | Young's modulus | Shear modulus | Poisson's ratio |
---|---|---|---|---|
Voigt | KV = 168.78 GPa | EV = 255.25 GPa | GV = 102.27 GPa | νV = 0.24795 |
Reuss | KR = 168.04 GPa | ER = 254.2 GPa | GR = 101.85 GPa | νR = 0.24788 |
Hill | KH = 168.41 GPa | EH = 254.72 GPa | GH = 102.06 GPa | νH = 0.24791 |
Eigenvalues of the stiffness matrix
λ1 | λ2 | λ3 | λ4 | λ5 | λ6 |
---|---|---|---|---|---|
102 GPa | 102 GPa | 108 GPa | 183.39 GPa | 214 GPa | 507.61 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 | 244.98 GPa | 258.88 GPa | 1.6758 TPa–1 | 2.1377 TPa–1 | 95.283 GPa | 108 GPa | 0.1617 | 0.30189 | Value |
Anisotropy | 1.057 | 1.2756 | 1.133 | 1.8670 | Anisotropy | ||||
Axis | 0.0000 0.0000 1.0000 |
-0.5349 0.5349 0.6540 |
0.0000 0.0000 1.0000 |
0.6088 0.7934 0.0000 |
0.7071 -0.0003 0.7071 |
1.0000 -0.0002 -0.0000 |
0.7071 0.7071 0.0000 |
0.7071 0.7071 -0.0000 |
Axis |
0.7071 -0.0005 -0.7071 |
0.0002 1.0000 -0.0000 |
-0.7071 0.7071 -0.0000 |
0.0003 -0.0003 -1.0000 |
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