A formulation of the ring polymer molecular dynamics

DOI10.1080/08927022.2010.547854zbMath1261.81114arXiv1401.0790OpenAlexW2963477453MaRDI QIDQ4905800

Atsushi Horikoshi

Publication date: 20 February 2013

Published in: Molecular Simulation (Search for Journal in Brave)

Full work available at URL: https://arxiv.org/abs/1401.0790

zbMATH Keywords

correlation functionsquantum dynamicspath integral molecular dynamics

Mathematics Subject Classification ID

Statistical mechanics of polymers (82D60) Closed and approximate solutions to the Schrödinger, Dirac, Klein-Gordon and other equations of quantum mechanics (81Q05) Path integrals in quantum mechanics (81S40) Molecular physics (81V55)

Cites Work

• The calculation of transport properties in quantum liquids using the maximum entropy numerical analytic continuation method: Application to liquid para -hydrogen
• Generalized Hamiltonian Dynamics
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