Phase diagram of a two-dimensional fluid with internal quantum states

被引:0
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作者
Marx, D. [1 ]
Sengupta, S. [1 ]
Nielaba, P. [1 ]
Binder, K. [1 ]
机构
[1] IBM Research Div, Ruschlikon, Switzerland
关键词
Density functional theory - Finite size scaling - Internal quantum states - Phase boundaries - Two dimensional fluid;
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摘要
A model molecular fluid with two-dimensional classical degrees of freedom and two internal quantum states is studied by path integral Monte Carlo simulations. The temperature-density phase diagram is obtained to a high degree of precision using finite-size scaling techniques and local structure analysis methods. We locate the phase boundaries of gas, liquid, square and hexagonal lattice solid phases together with a preferred internal quantum state resulting in tricritical and triple points. The simulation results for the liquid-solid transitions are compared with recent density functional theory calculations.
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