Monte Carlo Methods for Calculating Some Physical Properties of Large Molecules

DOI10.1137/S1064827503422221zbMath1075.65003OpenAlexW2023830471MaRDI QIDQ4652328

Nikolai A. Simonov, Michael Mascagni

Publication date: 25 February 2005

Published in: SIAM Journal on Scientific Computing (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1137/s1064827503422221

zbMATH Keywords

diffusionMonte Carlo methodLaplace equationrandom walkreaction rateelectrostatic energyfinite-difference approximationsmoleculewalk on spheres

Mathematics Subject Classification ID

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