An ASE calculator for the RASPA molecular simulation package.

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License: BSD-3

Author: Andrew S. Rosen

Tags RASPA, ASE, Molecular Simulations, Monte Carlo

Requires: Python <3.13, >=3.9

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raspa_ase

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An Atomic Simulation Environment (ASE) calculator for the RASPA molecular simulation code.

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Avatar for arosen from gravatar.com arosen

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View statistics for this project via Libraries.io, or by using our public dataset on Google BigQuery

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License: BSD-3

Author: Andrew S. Rosen

Tags RASPA, ASE, Molecular Simulations, Monte Carlo

Requires: Python <3.13, >=3.9

Classifiers

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0.0.1

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