Science Score: 33.0%
This score indicates how likely this project is to be science-related based on various indicators:
-
○CITATION.cff file
-
○codemeta.json file
-
○.zenodo.json file
-
✓DOI references
Found 3 DOI reference(s) in README -
✓Academic publication links
Links to: zenodo.org -
✓Committers with academic emails
2 of 7 committers (28.6%) from academic institutions -
○Institutional organization owner
-
○JOSS paper metadata
-
○Scientific vocabulary similarity
Low similarity (13.5%) to scientific vocabulary
Repository
A module for ASE for elastic constants calculation.
Basic Info
- Host: GitHub
- Owner: jochym
- License: gpl-3.0
- Language: Python
- Default Branch: master
- Size: 1.1 MB
Statistics
- Stars: 30
- Watchers: 7
- Forks: 21
- Open Issues: 31
- Releases: 17
Metadata Files
README.md
Elastic
Elastic is a set of python routines for calculation of elastic properties of crystals (elastic constants, equation of state, sound velocities, etc.). It is a third version of the in-house code I have written over few years and is implemented as a extension to the ASE system. The code was a basis for some of my publications and was described briefly in these papers. The code was available to anyone, presented at the Workshop on ab initio Calculations in Geosciences and used by some of my co-workers. This code is a re-implementation of elastic as a module for the ASE.
The on-line documentation is placed on ReadTheDocs or Elastic website. You can obtain the documentation as a PDF file as well.
Installation
The installation is simple if you are using conda package menager:
conda install -c conda-forge elastic
If you need a more elaborate installation instruction for computing environment to work with ASE - I have written just such a document. It is a first in the series of tutorials of this subject and you can find it under nbviewer link above.
The project is open and I welcome patches, ideas and other feedback.
Acknowledgments
In the past the project was partially supported by:
- Department of Computational Material Science, Institute of Nuclear Physics, PAN, Poland
- Department of Engineering, University of Saskatchewan, Canada
Owner
- Name: Paweł T. Jochym
- Login: jochym
- Kind: user
- Location: Cracow, Poland
- Company: Institute of Nuclear Physics, PAN, Poland
- Website: http://wolf.ifj.edu.pl/en/people/pawel-t-jochym
- Repositories: 127
- Profile: https://github.com/jochym
Physicist (solid state and computational physics), free software user, creator and enthusiast, amateur astronomer
GitHub Events
Total
- Create event: 5
- Release event: 1
- Issues event: 2
- Watch event: 11
- Issue comment event: 2
- Push event: 20
- Pull request event: 8
Last Year
- Create event: 5
- Release event: 1
- Issues event: 2
- Watch event: 11
- Issue comment event: 2
- Push event: 20
- Pull request event: 8
Committers
Last synced: about 2 years ago
Top Committers
| Name | Commits | |
|---|---|---|
| P.T. Jochym | p****m@i****l | 518 |
| Paweł T. Jochym | P****m@i****l | 46 |
| Paweł T. Jochym | j****m | 35 |
| Pawel T. Jochym | j****m@d****k | 12 |
| yuzie007 | y****p@g****m | 3 |
| Dr. Sefer Bora Lisesivdin | s****n@g****m | 1 |
| The Codacy Badger | b****r@c****m | 1 |
Committer Domains (Top 20 + Academic)
Issues and Pull Requests
Last synced: about 2 years ago
All Time
- Total issues: 9
- Total pull requests: 63
- Average time to close issues: over 1 year
- Average time to close pull requests: almost 4 years
- Total issue authors: 6
- Total pull request authors: 5
- Average comments per issue: 2.0
- Average comments per pull request: 0.02
- Merged pull requests: 7
- Bot issues: 0
- Bot pull requests: 0
Past Year
- Issues: 5
- Pull requests: 5
- Average time to close issues: 5 days
- Average time to close pull requests: 1 day
- Issue authors: 3
- Pull request authors: 2
- Average comments per issue: 2.0
- Average comments per pull request: 0.2
- Merged pull requests: 5
- Bot issues: 0
- Bot pull requests: 0
Top Authors
Issue Authors
- Ruoyan0103 (2)
- lim520 (2)
- stefanbringuier (1)
- goodwilling (1)
- yuzie007 (1)
- qzhu2017 (1)
- thangckt (1)
- diefenbach (1)
Pull Request Authors
- pyup-bot (79)
- jochym (10)
- yuzie007 (4)
- Kokookster (1)
- codacy-badger (1)
- sblisesivdin (1)
Top Labels
Issue Labels
Pull Request Labels
Packages
- Total packages: 2
-
Total downloads:
- pypi 1,111 last-month
-
Total dependent packages: 1
(may contain duplicates) -
Total dependent repositories: 10
(may contain duplicates) - Total versions: 96
- Total maintainers: 1
pypi.org: elastic
Extension for ASE to calculate elastic constants
- Homepage: https://wolf.ifj.edu.pl/elastic
- Documentation: http://elastic.rtfd.org/
- License: GPLv3
-
Latest release: 5.2.5
published over 1 year ago
Rankings
Maintainers (1)
conda-forge.org: elastic
Elastic is a set of python routines for calculation of elastic properties of crystals (elastic constants, equation of state, sound velocities, etc.). It is a third version of the code implemented as a extension to the ASE system. The code was a basis for some of my publications and was described briefly in these papers. The code was available to anyone, presented at the Workshop on ab initio Calculations in Geosciences and used by some of my co-workers.
- Homepage: http://jochym.github.io/Elastic/
- License: GPL-3.0-or-later
-
Latest release: 5.1.0
published about 8 years ago
Rankings
Dependencies
- ase *
- numpy *
- scipy *
- setuptools_scm *
- spglib *
- click *