THE DIFFUSION QUANTUM MONTE CARLO METHOD: DESIGNING TRIAL WAVE FUNCTIONS FOR NiO
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Publication:4453807
DOI10.1142/S0217979203020533zbMath1041.81623OpenAlexW3128659861MaRDI QIDQ4453807
M. D. Towler, Richard J. Needs
Publication date: 7 March 2004
Published in: International Journal of Modern Physics B (Search for Journal in Brave)
Full work available at URL: https://doi.org/10.1142/s0217979203020533
Monte Carlo methods (65C05) Many-body theory; quantum Hall effect (81V70) Software, source code, etc. for problems pertaining to quantum theory (81-04) Statistical mechanics of plasmas (82D10) Molecular physics (81V55)
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Comparison of polynomial approximations to speed up planewave-based quantum Monte Carlo calculations
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