pymatgen · PyPI

Some features may not work without JavaScript. Please try enabling it if you encounter problems.

Pymatgen (python materials genomics) is the python library that powers the Materials Project (http://www.materialsproject.org). These are some of the main features:

Highly flexible classes for the representation of Element, Site, Molecule, Structure objects.
Extensive io capabilities to manipulate many VASP input and output files (http://cms.mpi.univie.ac.at/vasp/) and the crystallographic information file format. This includes generating Structure objects from vasp input and output. There is also support for Gaussian input files and XYZ file for molecules.
Comprehensive tool to generate and view compositional and grand canonical phase diagrams.
Electronic structure analyses (DOS and Bandstructure).

The public version of pymatgen is free (as in free beer) to download and to use. However, we would also like you to help us improve this library by making your own contributions as well. These contributions can be in the form of additional tools or modules you develop, or even simple things such as bug reports. Please contact the maintainer of this library (shyue@mit.edu) to find out how to include your contributions via github or for bug reports.

Note that pymatgen, like all scientific research, will always be a work in progress. While the development team will always strive to avoid backward incompatible changes, they are sometimes unavoidable, and tough decisions have to be made for the long term health of the code.

For documentation and usage guide, please refer to the latest documentation at our github page (http://materialsproject.github.com/pymatgen/). If you wish to be notified via email of pymatgen releases, you may become a member of pymatgen’s Google Groups page (https://groups.google.com/forum/?fromgroups#!forum/pymatgen/).

Metadata

Release files for pymatgen 1.8.3

For a detailed explanation of source distributions (sdists) and built distributions (wheels), please see the package formats documentation.

Source distribution (sdist)

Source distribution for pymatgen 1.8.3
File	Size	Uploaded
pymatgen-1.8.3.tar.gz	169.4 kB	Apr 26, 2012	Details

Built distribution (wheel)

Table of built distributions (wheels) for pymatgen 1.8.3
File	Interpreter	ABI	Platform	Reset
pymatgen-1.8.3-py2.7.egg 606.6 kB Apr 26, 2012	Legacy Egg format	-	-	Details

Total release size: 776.0 kB

Release files / pymatgen-1.8.3.tar.gz

Download URL	pymatgen-1.8.3.tar.gz
Size	169.4 kB
Tags	Source
SHA-256 checksum How to use checksums	`e30494432b57bfe33ff2978b46360425b50c99026271d54d314f5f09b00bfffe`
BLAKE2b-256 checksum How to use checksums	`5c65d8d94df47af644673692476925544c31ed33de76e98d31457f5f517e4f50`
Upload date	Apr 26, 2012
Uploaded using Trusted Publishing? What is trusted publishing?	No

Release files / pymatgen-1.8.3-py2.7.egg

Download URL	pymatgen-1.8.3-py2.7.egg
Size	606.6 kB
Tags	Egg
SHA-256 checksum How to use checksums	`e8f450e03652345a2f3ff3e3bfe5458d4218932ccd5922f8db15e8dd6b8f6e26`
BLAKE2b-256 checksum How to use checksums	`36bae7b46cdb66cf10faf928c7ea3790a496275266920e40823f428632be553e`
Upload date	Apr 26, 2012
Uploaded using Trusted Publishing? What is trusted publishing?	No

Release history Release notifications | RSS feed

Sep 23, 2026 2 release files

Sep 23, 2026 1 release file

May 4, 2026 2 release files

Mar 23, 2026 2 release files

Oct 7, 2025 25 release files

Jun 14, 2025 24 release files

May 28, 2025 24 release files

May 2, 2025 24 release files

May 1, 2025 24 release files

Apr 24, 2025 24 release files

Apr 20, 2025 25 release files

Apr 19, 2025 20 release files

Apr 17, 2025 19 release files

Yanked

Apr 16, 2025 20 release files

Apr 10, 2025 19 release files

Mar 10, 2025 16 release files

Feb 18, 2025 16 release files

Jan 24, 2025 16 release files

Jan 23, 2025 16 release files

Jan 9, 2025 13 release files

Nov 13, 2024 13 release files

Oct 29, 2024 13 release files

Oct 27, 2024 13 release files

Oct 25, 2024 13 release files

Oct 22, 2024 13 release files

Oct 3, 2024 13 release files

Sep 18, 2024 13 release files

Sep 17, 2024 13 release files

Sep 10, 2024 12 release files

Aug 9, 2024 17 release files

Yanked

Aug 9, 2024 17 release files

Jul 18, 2024 17 release files

Jun 11, 2024 17 release files

Jun 4, 2024 17 release files

Yanked

May 31, 2024 17 release files

May 1, 2024 17 release files

Apr 13, 2024 13 release files

Apr 12, 2024 13 release files

Mar 1, 2024 13 release files

Feb 23, 2024 13 release files

Feb 21, 2024 13 release files

Feb 8, 2024 13 release files

Jan 27, 2024 2 release files

Jan 26, 2024 13 release files

Dec 19, 2023 13 release files

Nov 13, 2023 13 release files

Nov 10, 2023 13 release files

Oct 12, 2023 13 release files

Oct 4, 2023 14 release files

Oct 4, 2023 13 release files

Sep 25, 2023 14 release files

Sep 10, 2023 13 release files

Sep 2, 2023 14 release files

Aug 10, 2023 17 release files

Jul 20, 2023 17 release files

Jul 17, 2023 18 release files

Jul 14, 2023 18 release files

Jul 11, 2023 18 release files

Yanked

Jun 28, 2023 2 release files

Jun 24, 2023 17 release files

Jun 1, 2023 17 release files

May 10, 2023 18 release files

May 8, 2023 17 release files

Mar 23, 2023 18 release files

Mar 10, 2023 18 release files

Feb 28, 2023 17 release files

Feb 23, 2023 7 release files

Jan 30, 2023 8 release files

Jan 20, 2023 8 release files

Jan 9, 2023 7 release files

Nov 9, 2022 7 release files

Nov 1, 2022 2 release files

Oct 22, 2022 2 release files

Sep 21, 2022 2 release files

Sep 8, 2022 2 release files

Aug 23, 2022 8 release files

Jul 25, 2022 8 release files

Jul 24, 2022 8 release files

Yanked

Jul 24, 2022 8 release files

Jul 19, 2022 7 release files

Jul 9, 2022 7 release files

May 26, 2022 7 release files

May 19, 2022 8 release files

May 18, 2022 8 release files

May 18, 2022 8 release files

May 17, 2022 8 release files

Apr 26, 2022 8 release files

Apr 19, 2022 8 release files

Mar 29, 2022 7 release files

Mar 25, 2022 2 release files

Mar 22, 2022 8 release files

Mar 8, 2022 7 release files

Feb 10, 2022 8 release files

Feb 7, 2022 8 release files

Feb 1, 2022 8 release files

Jan 24, 2022 8 release files

Jan 20, 2022 8 release files

Jan 9, 2022 7 release files

Jan 8, 2022 6 release files

Dec 11, 2021 3 release files

Oct 22, 2021 5 release files

Oct 21, 2021 5 release files

Sep 6, 2021 5 release files

Sep 3, 2021 5 release files

Aug 25, 2021 5 release files

Jul 23, 2021 5 release files

Jul 1, 2021 5 release files

Jun 21, 2021 5 release files

May 9, 2021 5 release files

May 3, 2021 5 release files

Apr 22, 2021 5 release files

Mar 18, 2021 5 release files

Mar 9, 2021 3 release files

Mar 6, 2021 3 release files

Yanked

Mar 6, 2021 3 release files

Yanked

Mar 6, 2021 3 release files

Yanked

Mar 5, 2021 3 release files

Mar 9, 2021 3 release files

Mar 5, 2021 3 release files

Yanked

Mar 5, 2021 3 release files

Mar 3, 2021 3 release files

Feb 17, 2021 3 release files

Feb 15, 2021 3 release files

Feb 13, 2021 3 release files

Feb 8, 2021 4 release files

Feb 8, 2021 4 release files

Dec 31, 2020 4 release files

Dec 19, 2020 4 release files

Dec 4, 2020 4 release files

Nov 11, 2020 4 release files

Oct 20, 2020 4 release files

Oct 10, 2020 4 release files

Oct 9, 2020 4 release files

Sep 14, 2020 4 release files

Aug 13, 2020 3 release files

Aug 3, 2020 3 release files

Jul 18, 2020 4 release files

Jul 16, 2020 4 release files

Jul 14, 2020 3 release files

Jul 11, 2020 2 release files

Jul 3, 2020 3 release files

Jun 9, 2020 10 release files

Apr 29, 2020 3 release files

Apr 3, 2020 2 release files

Mar 13, 2020 2 release files

Mar 2, 2020 2 release files

Jan 29, 2020 3 release files

Jan 10, 2020 3 release files

Dec 23, 2019 3 release files

Dec 3, 2019 4 release files

Nov 11, 2019 3 release files

Oct 16, 2019 4 release files

Oct 4, 2019 4 release files

Oct 3, 2019 4 release files

Oct 2, 2019 2 release files

Sep 16, 2019 3 release files

Sep 12, 2019 2 release files

Sep 8, 2019 2 release files

Sep 8, 2019 2 release files

Aug 23, 2019 3 release files

Aug 14, 2019 2 release files

Jul 30, 2019 3 release files

Jul 22, 2019 3 release files

Jul 2, 2019 2 release files

Jun 21, 2019 2 release files

Jun 5, 2019 3 release files

May 28, 2019 2 release files

May 9, 2019 2 release files

May 1, 2019 3 release files

Apr 11, 2019 4 release files

Mar 28, 2019 2 release files

Mar 13, 2019 4 release files

Feb 28, 2019 2 release files

Feb 24, 2019 3 release files

Feb 4, 2019 4 release files

Jan 24, 2019 4 release files

Jan 13, 2019 3 release files

Dec 12, 2018 4 release files

Nov 30, 2018 3 release files

Nov 6, 2018 4 release files

Oct 18, 2018 3 release files

Sep 30, 2018 3 release files

Sep 20, 2018 3 release files

Sep 12, 2018 4 release files

Sep 1, 2018 3 release files

Aug 10, 2018 2 release files

Aug 7, 2018 3 release files

Jul 23, 2018 4 release files

Jul 15, 2018 3 release files

Jun 28, 2018 4 release files

Jun 11, 2018 3 release files

May 22, 2018 4 release files

May 21, 2018 4 release files

May 14, 2018 4 release files

May 3, 2018 4 release files

Apr 20, 2018 4 release files

Apr 6, 2018 4 release files

Mar 23, 2018 3 release files

Mar 15, 2018 4 release files

Mar 14, 2018 3 release files

Mar 2, 2018 4 release files

Feb 13, 2018 4 release files

Jan 29, 2018 4 release files

Jan 19, 2018 5 release files

Dec 30, 2017 5 release files

Dec 15, 2017 4 release files

Dec 15, 2017 5 release files

Dec 8, 2017 5 release files

Dec 6, 2017 5 release files

Nov 30, 2017 5 release files

Nov 28, 2017 5 release files

Nov 9, 2017 5 release files

Nov 6, 2017 5 release files

Oct 16, 2017 5 release files

Sep 23, 2017 5 release files

Sep 3, 2017 5 release files

Sep 1, 2017 5 release files

Aug 21, 2017 5 release files

Aug 20, 2017 5 release files

Aug 16, 2017 5 release files

Aug 15, 2017 5 release files

Aug 4, 2017 4 release files

Jul 22, 2017 4 release files

Jul 4, 2017 6 release files

Jun 24, 2017 5 release files

Jun 22, 2017 5 release files

Jun 8, 2017 4 release files

May 27, 2017 5 release files

May 14, 2017 5 release files

May 9, 2017 5 release files

Apr 19, 2017 5 release files

Apr 1, 2017 5 release files

Mar 24, 2017 5 release files

Mar 9, 2017 5 release files

Mar 7, 2017 5 release files

Feb 13, 2017 4 release files

Feb 2, 2017 5 release files

Jan 16, 2017 5 release files

Jan 3, 2017 5 release files

Dec 21, 2016 4 release files

Dec 20, 2016 4 release files

Dec 16, 2016 4 release files

Dec 3, 2016 4 release files

Nov 16, 2016 4 release files

Nov 16, 2016 4 release files

Nov 2, 2016 4 release files

Nov 2, 2016 4 release files

Oct 30, 2016 4 release files

Oct 30, 2016 3 release files

Oct 23, 2016 4 release files

Oct 19, 2016 4 release files

Oct 19, 2016 3 release files

Oct 18, 2016 4 release files

Oct 17, 2016 4 release files

Oct 17, 2016 4 release files

Oct 17, 2016 4 release files

Oct 17, 2016 4 release files

Oct 12, 2016 4 release files

Sep 28, 2016 4 release files

Sep 21, 2016 4 release files

Sep 17, 2016 4 release files

Sep 12, 2016 4 release files

Sep 8, 2016 4 release files

Sep 8, 2016 3 release files

Sep 7, 2016 3 release files

Sep 3, 2016 2 release files

Aug 5, 2016 2 release files

Jul 21, 2016 2 release files

Jul 16, 2016 2 release files

Jul 14, 2016 2 release files

Jul 9, 2016 2 release files

Jul 9, 2016 2 release files

Jul 2, 2016 2 release files

Jun 20, 2016 2 release files

Jun 19, 2016 3 release files

May 26, 2016 2 release files

May 15, 2016 2 release files

May 12, 2016 2 release files

May 1, 2016 2 release files

Apr 30, 2016 2 release files

Apr 21, 2016 2 release files

Apr 1, 2016 2 release files

Mar 18, 2016 2 release files

Feb 19, 2016 2 release files

Jan 19, 2016 2 release files

Jan 16, 2016 2 release files

Jan 11, 2016 2 release files

Jan 5, 2016 2 release files

Jan 3, 2016 2 release files

Dec 15, 2015 2 release files

Dec 12, 2015 2 release files

Dec 6, 2015 2 release files

Nov 20, 2015 2 release files

Nov 19, 2015 2 release files

Nov 6, 2015 2 release files

Oct 30, 2015 2 release files

Oct 2, 2015 2 release files

Oct 2, 2015 1 release file

Sep 18, 2015 2 release files

Sep 10, 2015 2 release files

Aug 27, 2015 2 release files

Aug 27, 2015 2 release files

Aug 24, 2015 2 release files

Aug 6, 2015 2 release files

Aug 3, 2015 2 release files

Aug 2, 2015 2 release files

Aug 2, 2015 2 release files

Jul 30, 2015 2 release files

Jul 20, 2015 2 release files

Jun 19, 2015 2 release files

Mar 22, 2015 2 release files

Mar 22, 2015

Feb 21, 2015 2 release files

Feb 5, 2015 2 release files

Dec 12, 2014 2 release files

Dec 1, 2014 2 release files

Oct 30, 2014 2 release files

Oct 6, 2014 2 release files

Oct 2, 2014 2 release files

Sep 23, 2014 2 release files

Sep 23, 2014 2 release files

Sep 16, 2014 3 release files

Sep 12, 2014 2 release files

Sep 12, 2014 2 release files

Sep 7, 2014 2 release files

Sep 4, 2014 2 release files

Sep 4, 2014 2 release files

Aug 28, 2014 2 release files

Aug 18, 2014 2 release files

Aug 15, 2014 2 release files

Aug 15, 2014 2 release files

Aug 5, 2014 2 release files

Jul 25, 2014 2 release files

Jul 22, 2014 2 release files

Jun 6, 2014 2 release files

Jun 5, 2014 2 release files

May 28, 2014 2 release files

May 23, 2014 2 release files

May 1, 2014 2 release files

Apr 30, 2014 2 release files

Apr 4, 2014 2 release files

Mar 14, 2014 2 release files

Mar 5, 2014 2 release files

Feb 20, 2014 2 release files

Feb 9, 2014 2 release files

Jan 25, 2014 1 release file

Dec 19, 2013 2 release files

Dec 16, 2013 2 release files

Nov 14, 2013 2 release files

Oct 27, 2013 2 release files

Sep 30, 2013 2 release files

Sep 30, 2013 2 release files

Sep 17, 2013 2 release files

Sep 16, 2013 2 release files

Sep 15, 2013 2 release files

Sep 6, 2013 2 release files

Aug 22, 2013 2 release files

Aug 21, 2013 2 release files

Aug 12, 2013 2 release files

Aug 1, 2013 2 release files

Jun 23, 2013 2 release files

Jun 18, 2013 2 release files

Jun 4, 2013 2 release files

Pre-release

May 23, 2013 2 release files

May 12, 2013 2 release files

May 3, 2013 2 release files

Apr 19, 2013 2 release files

Apr 8, 2013 2 release files

Apr 5, 2013 2 release files

Mar 31, 2013 2 release files

Mar 24, 2013 2 release files

Mar 19, 2013 2 release files

Mar 5, 2013 2 release files

Feb 25, 2013 2 release files

Feb 20, 2013 2 release files

Feb 19, 2013 2 release files

Feb 8, 2013 2 release files

Feb 7, 2013 2 release files

Jan 27, 2013 2 release files

Jan 27, 2013 2 release files

Jan 14, 2013 2 release files

Jan 4, 2013 2 release files

Dec 5, 2012 2 release files

Dec 3, 2012 2 release files

Nov 27, 2012 2 release files

Nov 19, 2012 2 release files

Nov 1, 2012 2 release files

Oct 11, 2012 2 release files

Sep 20, 2012 2 release files

Sep 13, 2012 2 release files

Aug 7, 2012 2 release files

Jul 27, 2012 2 release files

Jul 27, 2012 2 release files

Jul 9, 2012 2 release files

May 10, 2012 2 release files

This release

1.8.3 This release

Apr 26, 2012 2 release files

Apr 26, 2012 2 release files

Apr 19, 2012 2 release files

Apr 7, 2012 2 release files

Apr 2, 2012 2 release files

Mar 19, 2012 2 release files

Mar 9, 2012 2 release files

Mar 2, 2012 2 release files

Mar 2, 2012 2 release files

Feb 26, 2012 2 release files

Feb 10, 2012 2 release files

Feb 3, 2012 2 release files

Jan 22, 2012 2 release files

Jan 8, 2012 1 release file

Nov 30, 2011 1 release file

Nov 24, 2011 1 release file

Nov 18, 2011 1 release file

Nov 15, 2011 1 release file

Nov 12, 2011 1 release file

Anthropic, PBC Visionary sponsor

Bloomberg Visionary sponsor

Hudson River Trading Visionary sponsor

Meta Visionary sponsor

NVIDIA Visionary sponsor

Microsoft Sustainability sponsor

Depot Continuous Integration

AWS Cloud computing and Security Sponsor

Datadog Monitoring

Google Download Analytics

Sentry Error logging

StatusPage Status page