MechElastic | Python library to calculate elastic properties

by romerogroup Python Version: 1.2.29 License: GPL-3.0

X-Ray Key Features Code Snippets(3)Community Discussions Vulnerabilities Install Support

kandi X-RAY | MechElastic Summary

MechElastic is a Python library. MechElastic has no bugs, it has no vulnerabilities, it has build file available, it has a Strong Copyleft License and it has low support. You can install using 'pip install MechElastic' or download it from GitHub, PyPI.

This Python library can be used to calculate some important physical properties such as elastic moduli, melting temperature, Debye temperature, elastic wave velocities, elastic anisotropy, etc. for all crystalline systems using output data from an elastic tensor calculation. It can also be used to test the mechanical stability of any bulk system. MechElastic reads the elastic matrix written in the output files from DFT codes. Additionally, MechElastic allows performing Equation of State (EOS) analysis provided inputs of Volume and Energy or Volume and Pressure.

Support

Quality

Security

License

Reuse

Support

MechElastic has a low active ecosystem.

It has 21 star(s) with 12 fork(s). There are 3 watchers for this library.

It had no major release in the last 12 months.

There are 2 open issues and 0 have been closed. There are no pull requests.

It has a neutral sentiment in the developer community.

The latest version of MechElastic is 1.2.29

Quality

MechElastic has no bugs reported.

Security

MechElastic has no vulnerabilities reported, and its dependent libraries have no vulnerabilities reported.

License

MechElastic is licensed under the GPL-3.0 License. This license is Strong Copyleft.

Strong Copyleft licenses enforce sharing, and you can use them when creating open source projects.

Reuse

MechElastic releases are not available. You will need to build from source code and install.

Deployable package is available in PyPI.

Build file is available. You can build the component from source.

Installation instructions are not available. Examples and code snippets are available.

Top functions reviewed by kandi - BETA

kandi has reviewed MechElastic and discovered the below as its top functions. This is intended to give you an instant insight into MechElastic implemented functionality, and help decide if they suit your requirements.

Plot the energy and energy volume
Estimate the peos
R Calculates the EOS coefficient of a birch
Compute the eos birch murnaghan equation
Prints the average properties
Generate a rotation vector
Compute the direction of the direction vector
Calculate elasticanisotropy
Print the average properties
Plot energy and energy data
Calculate the energy of the eos_murnaghan model
Calculate DebyeSpeed using the Debye method
Poisson Poisson function
Calculate DebyeSpeed using Debye method
Calculate elastic properties
Calculate the Isosurface surface
Compute the ratio of compressional shear
Bulk function
Calculates the shear function of x
Computes the compression speed of a 3D array
Calculate the shear speed of the shear transform
Computes the ratio of the ratio of the compressed shear shear
Calculate the Pugh ratio
Computes the compression speed of a 2D image
Parses the input files and returns a dictionary
Parses the input files
Plot a 3D mesh

Get all kandi verified functions for this library.

MechElastic Key Features

No Key Features are available at this moment for MechElastic.

MechElastic Examples and Code Snippets

MechElastic,Citing information

Python

Lines of Code : 24

License : Strong Copyleft (GPL-3.0)

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@article{PhysRevB.97.054108,
  title = {Elastic, mechanical, and thermodynamic properties of Bi-Sb binaries: Effect of spin-orbit coupling},
  author = {Singh, Sobhit and Valencia-Jaime, Irais and Pavlic, Olivia and Romero, Aldo H.},
  journal = {Phy

MechElastic,Usage

Python

Lines of Code : 2

License : Strong Copyleft (GPL-3.0)

Copy

mechelastic -h

mechelastic -d=3D -i OUTCAR-Si_bulk

MechElastic,Installation

Python

Lines of Code : 1

License : Strong Copyleft (GPL-3.0)

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pip install mechelastic

Community Discussions

No Community Discussions are available at this moment for MechElastic.Refer to stack overflow page for discussions.

Community Discussions, Code Snippets contain sources that include Stack Exchange Network

Vulnerabilities

No vulnerabilities reported

Install MechElastic

You can install using 'pip install MechElastic' or download it from GitHub, PyPI.
You can use MechElastic like any standard Python library. You will need to make sure that you have a development environment consisting of a Python distribution including header files, a compiler, pip, and git installed. Make sure that your pip, setuptools, and wheel are up to date. When using pip it is generally recommended to install packages in a virtual environment to avoid changes to the system.

Support

For any new features, suggestions and bugs create an issue on GitHub. If you have any questions check and ask questions on community page Stack Overflow .

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