Monte Carlo results for the hydrogen Hugoniot

We propose a theoretical Hugoniot obtained by combining results for the equation of state (EOS) from the Direct Path Integral Monte Carlo technique (DPIMC) and those from Reaction Ensemble Monte Carlo (REMC) simulations. The main idea of such proposal is based on the fact that DPMIC provides first-principle results for a wide range of densities and temperatures including the region of partially ionized plasmas. On the other hand, for lower temperatures where the formation of molecules becomes dominant, DPIMC simulations become cumbersome and inefficient. For this region it is possible to use accurate REMC simulations where bound states (molecules) are treated on the Born-Oppenheimer level using a binding potential calculated by Kolos and Wolniewicz. The remaining interaction is then reduced to the scattering between neutral particles which is reliably treated classically applying effective potentials. The resulting Hugoniot is located between the experimental values of Knudson {\textit{et al.}} \cite{1} and Collins {\textit{et al.}} \cite{2}.Comment: 10 pges, 2 figures, 2 table

Path integral Monte Carlo calculations of helium and hydrogen-helium plasma thermodynamics and of the deuterium shock Hugoniot

In this work we calculate the thermodynamic properties of hydrogen-helium plasmas with different mass fractions of helium by the direct path integral Monte Carlo method. To avoid unphysical approximations we use the path integral representation of the density matrix. We pay special attention to the region of weak coupling and degeneracy and compare the results of simulation with a model based on the chemical picture. Further with the help of calculated deuterium isochors we compute the shock Hugoniot of deuterium. We analyze our results in comparison with recent experimental and calculated data on the deuterium Hugoniot.Comment: 7 pages, 5 Postscript figures, accepted for publication in J. Phys. A: Math. Ge