{"library":"pymatgen-analysis-diffusion","type":"library","category":null,"description":"Pymatgen-analysis-diffusion is an add-on module for the Materials Project's `pymatgen` library, specializing in the analysis of diffusion in solid-state materials. It provides tools for calculating mean squared displacement (MSD), determining diffusion coefficients from ab-initio molecular dynamics (AIMD) simulations, and analyzing diffusion paths. The current version is 2025.11.15, and releases are typically date-based, often aligning with updates to the core `pymatgen` library.","language":"python","status":"active","version":"2025.11.15","tags":["material-science","solid-state","diffusion","AIMD","pymatgen","computational-materials-science"],"install":[{"cmd":"pip install pymatgen-analysis-diffusion","imports":["from pymatgen.analysis.diffusion.aimd.msd import MSDAnalyzer"]}],"homepage":"http://materialsvirtuallab.github.io/pymatgen-analysis-diffusion/","github":"https://github.com/materialsvirtuallab/pymatgen-analysis-diffusion","docs":"http://materialsvirtuallab.github.io/pymatgen-analysis-diffusion/","changelog":null,"pypi":"https://pypi.org/project/pymatgen-analysis-diffusion/","npm":null,"openapi_spec":null,"status_page":null,"smithery":null,"compatibility":{"summary":{"python_range":"3.10–3.9","success_rate":50,"avg_install_s":29.8,"avg_import_s":null,"wheel_type":"sdist"},"url":"https://checklist.day/v1/registry/pymatgen-analysis-diffusion/compatibility"},"provenance":{"verified_status":"import_fail","verified_at":"Fri Jul 03","last_verified":"Fri Jul 03","next_check":"Fri Jul 10","install_tag":null}}