Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code

13 Mar 2020 · Needs R. J., Towler M. D., Drummond N. D., Rios P. Lopez, Trail J. R. ·

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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Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code

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