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    Rights statement: Copyright 2020 American Institute of Physics. The following article appeared in The Journal of Chemical Physics, 152, 15 2020 and may be found at http://dx.doi.org/10.1063/1.5144288 This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics.

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Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code

Research output: Contribution to Journal/Magazine › Journal article › peer-review

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Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code. / Needs, Richard; Towler, M. D.; Drummond, Neil et al.
In: Journal of Chemical Physics, Vol. 152, No. 15, 154106, 21.04.2020.

Research output: Contribution to Journal/Magazine › Journal article › peer-review

Harvard

Needs, R, Towler, MD, Drummond, N, Lopez Rios, P & Trail, JR 2020, 'Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code', Journal of Chemical Physics, vol. 152, no. 15, 154106. https://doi.org/10.1063/1.5144288

APA

Needs, R., Towler, M. D., Drummond, N., Lopez Rios, P., & Trail, J. R. (2020). Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code. Journal of Chemical Physics, 152(15), Article 154106. https://doi.org/10.1063/1.5144288

Vancouver

Needs R, Towler MD, Drummond N, Lopez Rios P, Trail JR. Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code. Journal of Chemical Physics. 2020 Apr 21;152(15):154106. doi: 10.1063/1.5144288

Author

Needs, Richard ; Towler, M. D. ; Drummond, Neil et al. / Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code. In: Journal of Chemical Physics. 2020 ; Vol. 152, No. 15.

Bibtex

@article{4bcad13ca3b54d5585a45742e35817d1,
title = "Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code",
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.",
author = "Richard Needs and Towler, {M. D.} and Neil Drummond and {Lopez Rios}, Pablo and Trail, {J. R.}",
note = "Copyright 2020 American Institute of Physics. The following article appeared in The Journal of Chemical Physics, 152, 15 2020 and may be found at http://dx.doi.org/10.1063/1.5144288 This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics. ",
year = "2020",
month = apr,
day = "21",
doi = "10.1063/1.5144288",
language = "English",
volume = "152",
journal = "Journal of Chemical Physics",
issn = "0021-9606",
publisher = "AMER INST PHYSICS",
number = "15",

}

RIS

TY - JOUR

T1 - Variational and Diffusion Quantum Monte Carlo Calculations with the CASINO Code

AU - Needs, Richard

AU - Towler, M. D.

AU - Drummond, Neil

AU - Lopez Rios, Pablo

AU - Trail, J. R.

N1 - Copyright 2020 American Institute of Physics. The following article appeared in The Journal of Chemical Physics, 152, 15 2020 and may be found at http://dx.doi.org/10.1063/1.5144288 This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics.

PY - 2020/4/21

Y1 - 2020/4/21

N2 - 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.

AB - 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.

U2 - 10.1063/1.5144288

DO - 10.1063/1.5144288

M3 - Journal article

VL - 152

JO - Journal of Chemical Physics

JF - Journal of Chemical Physics

SN - 0021-9606

IS - 15

M1 - 154106

ER -