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Pytorch Implementation of Real Space Quantum Monte Carlo Simulations of Molecular Systems

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QMCTorch

Pytorch Implementation of Real Space Quantum Monte Carlo Simulations of Molecular Systems

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Installation

Clone the repository and install the code from source or use the Python package manager:

pip install qmctorch

Documentation

https://qmctorch.readthedocs.io/en/latest/intro.html

Disclaimer

QMCTorch is currently under developmement and most likely won't behave as expected