A general purpose library to study vibrational problems using diffusion monte carlo
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Updated
Sep 26, 2024 - Python
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diffusion-monte-carlo
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jQMC code implements two real-space ab initio quantum Monte Carlo (QMC) methods. Variatioinal Monte Carlo (VMC) and lattice regularized diffusion Monte Carlo (LRDMC) methods. jQMC achieves high-performance computations especially on GPUs.
python3 neural-networks gpu-acceleration flax gpu-computing quantum-monte-carlo electronic-structure jax variational-monte-carlo diffusion-monte-carlo ab-initio-simulations optax neural-quantum-states
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Updated
Apr 15, 2026 - Python
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