pyscal3
faster and more efficient pyscal distribution
faster and more efficient pyscal distribution
To install this package, run one of the following:
pyscal is a python module for the calculation of local atomic structural environments including Steinhardt's bond orientational order parameters [1] during post-processing of atomistic simulation data. The core functionality of pyscal is written in C++ with python wrappers using pybind11 which allows for fast calculations with possibilities for easy expansion in python.
Summary
faster and more efficient pyscal distribution
Last Updated
May 19, 2025 at 11:30
License
GPL-3.0
Total Downloads
492.8K
Supported Platforms
Home
https://pyscal.orgGitHub Repository
https://github.com/pyscal/pyscal3/Documentation
https://v3.pyscal.org