Spin-Orbit Quantum Monte Carlo for heavy element Equations of state
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Volume-temperature data at atmospheric pressure used to verify principle of corresponding states for oligomer and high polymer liquids
Equilibrium configurations of self-gravitating particles systems by self consistent fields method
Hadron matter thermodynamical properties at high temperatures, developing dual resonance dynamic model of high energy particle interactions
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A numerical scheme using the method of characteristics to calculate the flow properties and pressures behind decaying shock waves for materials under hypervelocity impact is developed. Time-consuming double interpolation subroutines are replaced by a technique based on orthogonal polynomial least square surface fits. Typical calculated results are given and compared with the double interpolation results. The complete computer program is included.
A curve of applied pressure P versus lattice constant a is calculated for single crystal aluminum. It results from an application of the method of structural expansions for deriving the energies of simple metals, a method known to give reasonable results for the elastic constants even at second order in the effective electron-ion interaction. The method is taken from Fermi surface analysis . This essentially experimental information is used to verify that the extant face-centered cubic structure remains the preferred crystalline phase up to the highest pressures considered. Arguments are given to suggest that the P versus a curve should have reasonable a priori accuracy, which may be improved if experimental data in the intermediate pressure region can be provided to refine the energy dependent pseudo-potential. At 3 megabars the lattice constant is reduced by only 22%; the ion cores at this pressure are still very well separated.