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Thermodynamics And Equilibrium Structure Of Ne-38 Cluster: Quantum Mechanics Versus Classical
JOURNAL OF CHEMICAL PHYSICS, no. 15 (2005): 154305-154305
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摘要
The equilibrium properties of classical Lennard-Jones (LJ(38)) versus quantum Ne-38 Lennard-Jones clusters are investigated. The quantum simulations use both the path-integral Monte Carlo (PIMC) and the recently developed variational-Gaussian wave packet Monte Carlo (VGW-MC) methods. The PIMC and the classical MC simulations are implement...更多
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