Quantum Monte Carlo approaches for tackling electronic correlation

DOI10.1142/9781848167254_0009MaRDI QIDQ2848243zbMATH OpenOpenAlexFDO

Authors Massimo Mella, Gabriele Morosi

Publication date 26 September 2013

Published in Solving the Schrödinger Equation (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1142/9781848167254_0009

Mathematics Subject Classification ID

Monte Carlo methods (65C05) Computational methods for problems pertaining to quantum theory (81-08) Closed and approximate solutions to the Schrödinger, Dirac, Klein-Gordon and other equations of quantum mechanics (81Q05) Atomic physics (81V45) Molecular physics (81V55)

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(4)

• Full band Monte Carlo simulation - beyond the semiclassical approach
• Improved scaling for quantum Monte Carlo on insulators
• Classification of nodal pockets in many-electron wave functions via machine learning
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