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arXiv · 2003.06506

Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code

R. J. Needs·M. D. Towler·N. D. Drummond·P. Lopez Rios·J. R. Trail
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Abstract

We present an overview of the variational and diffusion quantum Monte Carlo methods as implemented in the CASINO program. We particularly focus on developments made in the last decade, describing state-of-the-art quantum Monte Carlo algorithms and software and discussing their strengths and their weaknesses. We review a range of recent applications of CASINO.

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R. J. Needs, M. D. Towler, N. D. Drummond, P. Lopez Rios, J. R. Trail. 2020-03-13. Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code. https://doi.org/10.1063/1.5144288

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