Jastrow wave function and correlations of the Lennard-Jones Bose fluid
- 1 August 1980
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 22 (3) , 1237-1249
- https://doi.org/10.1103/physrevb.22.1237
Abstract
We present results of Monte Carlo variational calculations for the ground state of the Lennard-Jones fluid. The Jastrow pseudopotential contains a correlation structure, that has been suggested to manifest the zero-point motion of rotons, at a distance of the order of first and second shell of neighbors. We find an improved ground-state energy, and its density dependence is in fair agreement with the "exact" result. The variational and are now in excellent agreement with the "exact" result. A comparison is made with the functional minimization approach. Computation of at finite temperature is performed with Penrose's density matrix by the Monte Carlo method and by application of perturbation theory of classical liquids.
Keywords
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