pengwann

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Computation of chemical bonding descriptors from Wannier functions

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To install this package, run one of the following:

$conda install conda-forge::pengwann

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A lightweight Python package for calculating descriptors of chemical bonding and local electronic structure from Wannier functions.

Summary

Computation of chemical bonding descriptors from Wannier functions

Last Updated

Apr 18, 2025 at 06:41

License

GPL-3.0-or-later

Total Downloads

6.9K

Supported Platforms

win-64

macOS-arm64

macOS-64

linux-aarch64

linux-64

linux-ppc64le

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