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Published November 3, 2023 | Version v1.3.1
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PyBEST

  • 1. Institute of Physics, Faculty of Physics, Astronomy and Informatics, Nicolaus Copernicus University in Toruń
  • 2. Institute of Physics, Faculty of Physics, Astronomy and Informatics, Nicolaus Copernicus University in Toruń
  • 3. Faculty of Chemistry, Nicolaus Copernicus University in Toruń

Contributors

  • 1. Institute of Physics, Faculty of Physics, Astronomy and Informatics, Nicolaus Copernicus University in Toruń

Description

PyBEST is a Pythonic Black-box Electronic Structure Tool, written primarily in the Python programming language with additional parts written in C++ and interfaced using pybind11.

 

Files

Files (8.8 MB)

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md5:73100de9e3a3dd7b2913ccc34c925521
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Additional details

Dates

Created
2023-11-03