Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code
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arXiv
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| Main Authors: | , , , , |
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| Format: | Preprint |
| Published: |
2020
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| _version_ | 1866909973938700288 |
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| author | Needs, R. J. Towler, M. D. Drummond, N. D. Rios, P. Lopez Trail, J. R. |
| author_facet | Needs, R. J. Towler, M. D. Drummond, N. D. Rios, P. Lopez Trail, J. R. |
| contents | 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. |
| format | Preprint |
| id |
arxiv_https___arxiv_org_abs_2003_06506 |
| institution | arXiv |
| publishDate | 2020 |
| record_format | arxiv |
| spellingShingle | Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code Needs, R. J. Towler, M. D. Drummond, N. D. Rios, P. Lopez Trail, J. R. Computational Physics Materials Science 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. |
| title | Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code |
| topic | Computational Physics Materials Science |
| url | https://arxiv.org/abs/2003.06506 |