This is the phono3py module.

Project description

phono3py

A simulation package of phonon-phonon interaction related properties mainly written in python. Phono3py user documentation is found at http://phonopy.github.io/phono3py/.

Mailing list for questions

Usual phono3py questions should be sent to phonopy mailing list (https://sourceforge.net/p/phonopy/mailman/).

Dependency

See requirements.txt. Optionally symfc and scipy are required for using additional features.

Development

The development of phono3py is managed on the develop branch of github phono3py repository.

Github issues is the place to discuss about phono3py issues.
Github pull request is the place to request merging source code.
Formatting rules are found in pyproject.toml.

Not strictly, but VSCode's settings.json may be written like below

"ruff.lint.args": [
    "--config=${workspaceFolder}/pyproject.toml",
],
"[python]": {
    "editor.defaultFormatter": "charliermarsh.ruff",
    "editor.codeActionsOnSave": {
        "source.organizeImports": "explicit"
    }
},

Use of pre-commit (https://pre-commit.com/) is encouraged.
- Installed by pip install pre-commit, conda install pre_commit or see https://pre-commit.com/#install.
- pre-commit hook is installed by pre-commit install.
- pre-commit hook is run by pre-commit run --all-files.

Documentation

Phono3py user documentation is written using python sphinx. The source files are stored in doc directory. Please see how to write the documentation at doc/README.md.

How to run tests

Tests are written using pytest. To run tests, pytest has to be installed. The tests can be run by

% pytest

Project details

Release history Release notifications | RSS feed

3.7.0

Nov 13, 2024

3.6.0

Nov 3, 2024

3.5.2

Sep 24, 2024

3.5.1

Sep 19, 2024

This version

3.5.0

Sep 13, 2024

3.4.0

Aug 23, 2024

3.3.4

Aug 8, 2024

3.3.3

Aug 6, 2024

3.3.2

Jul 22, 2024

3.3.1

Jul 15, 2024

3.3.0

Jul 8, 2024

3.2.0

Jun 29, 2024

3.1.2

Jun 19, 2024

3.1.1

Jun 7, 2024

3.1.0

Jun 7, 2024

3.0.4

Jun 6, 2024

3.0.3

May 4, 2024

3.0.2

Apr 21, 2024

3.0.1

Apr 20, 2024

3.0.0

Apr 19, 2024

2.10.0

Mar 20, 2024

2.9.2

Feb 2, 2024

2.9.1

Dec 26, 2023

2.9.0

Dec 25, 2023

2.8.0

Dec 4, 2023

2.7.0

Jul 3, 2023

2.6.0

Apr 3, 2023

2.5.1

Dec 30, 2022

2.5.0

Dec 29, 2022

2.4.1

Oct 6, 2022

2.4.0

Oct 5, 2022

2.3.2

May 28, 2022

2.3.1

May 7, 2022

2.3.0

Apr 9, 2022

2.2.0

Feb 13, 2022

2.1.0

Nov 3, 2021

2.0.0

Jul 22, 2021

1.22.3

Mar 17, 2021

1.22.2

Feb 21, 2021

1.22.1

Feb 21, 2021

1.22.0

Jan 29, 2021

1.21.0

Sep 30, 2020

1.20.0

Jul 31, 2020

1.19.1

May 3, 2020

1.19.0.post40

May 2, 2020

1.19.0.post15

May 3, 2020

1.19.0.post14

May 3, 2020

1.19.0.post13

May 2, 2020

1.19.0.post8

May 2, 2020

1.19.0.post7

May 2, 2020

1.19.0.post6

May 2, 2020

1.18.2.post1

Dec 22, 2019

1.18.2

Dec 22, 2019

1.18.1.post3

Oct 17, 2019

1.18.1

Oct 17, 2019

1.18.0.post4

Oct 17, 2019

1.18.0.post3

Oct 9, 2019

1.18.0.post2

Oct 9, 2019

1.18.0.post1

Oct 9, 2019

1.18.0

Oct 9, 2019

1.17.0.post1

Jun 25, 2019

1.17.0

Apr 18, 2019

1.16.0.post1

Mar 24, 2019

1.16.0

Mar 24, 2019

1.14.3.post1

Nov 22, 2018

1.14.3

Nov 22, 2018

1.13.3.27

Aug 11, 2018

1.13.3.24

Aug 10, 2018

1.13.3.18

Aug 9, 2018

1.13.3.15

Aug 9, 2018

1.13.3.11

Aug 9, 2018

1.13.3.6

Jul 9, 2018

1.13.3.1

Jun 20, 2018

1.13.3

Jun 20, 2018

1.13.1.37

Jun 12, 2018

1.13.1.34

Jun 10, 2018

1.13.1.28

Jun 10, 2018

1.13.1.24

Jun 2, 2018

1.13.1.20

Jun 2, 2018

1.13.1.17

Jun 2, 2018

1.13.1.8

May 18, 2018

1.13.1.4

May 17, 2018

1.13.1

May 17, 2018

1.12.9.22

Apr 10, 2018

1.12.9.13

Mar 22, 2018

1.12.9.5

Mar 16, 2018

1.12.7.55

Mar 10, 2018

1.12.7.46

Feb 18, 2018

1.12.7.37

Feb 17, 2018

1.12.7.36

Feb 16, 2018

1.12.7.33

Feb 15, 2018

1.12.7

Feb 1, 2018

1.12.5.48

Jan 22, 2018

1.12.5.45

Dec 25, 2017

1.12.5.41

Dec 25, 2017

1.12.5.35

Nov 30, 2017

1.12.5.30

Nov 29, 2017

1.12.5.23

Nov 27, 2017

1.12.5.10

Nov 25, 2017

1.12.5.8

Nov 25, 2017

1.12.5.1

Nov 22, 2017

1.12.5

Nov 22, 2017

1.12.3.29

Nov 21, 2017

1.12.3.25

Nov 21, 2017

1.12.3.15

Nov 17, 2017

1.12.3.4

Nov 16, 2017

1.12.3

Nov 15, 2017

1.11.13.47

Jul 25, 2017

1.11.13.39

Jul 19, 2017

1.11.13.35

Jul 17, 2017

1.11.13.28

Jul 13, 2017

1.11.13.23

Jul 12, 2017

1.11.13.22

Jul 12, 2017

1.11.13.21

Jul 12, 2017

1.11.13.19

Jul 12, 2017

1.11.13.18

Jul 12, 2017

1.11.13.17

Jul 12, 2017

1.11.13.16

Jul 12, 2017

1.11.13.15

Jul 12, 2017

1.11.13.14

Jul 12, 2017

1.11.13.13

Jul 11, 2017

1.11.13.10

Jul 7, 2017

1.11.13

Jun 18, 2017

1.11.11.111

Jun 7, 2017

1.11.11.92

Apr 25, 2017

1.11.11.89

Apr 24, 2017

1.11.11.77

Apr 18, 2017

1.11.11.71

Apr 16, 2017

1.11.11.38

Apr 10, 2017

1.11.11.18

Apr 6, 2017

1.11.11.14

Apr 4, 2017

1.11.11.6

Apr 2, 2017

1.11.11

Mar 31, 2017

1.11.9.30

Mar 12, 2017

1.11.9.26

Mar 12, 2017

1.11.9.20

Mar 10, 2017

1.11.9.14

Feb 27, 2017

1.11.9.1

Feb 7, 2017

1.11.7.20

Jan 20, 2017

1.11.7.16

Jan 1, 2017

1.11.7.13

Dec 23, 2016

1.11.7.8

Dec 15, 2016

1.11.7

Dec 14, 2016

1.11.5.39

Dec 13, 2016

1.11.5.35

Dec 11, 2016

1.11.5.30

Dec 11, 2016

1.11.5.23

Dec 9, 2016

1.11.5.15

Nov 29, 2016

1.11.5.8

Nov 28, 2016

1.11.5

Nov 27, 2016

1.11.3.29

Nov 15, 2016

1.11.3.15

Oct 31, 2016

1.11.3.11

Oct 30, 2016

1.11.3

Oct 30, 2016

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