Analysis of couette flow and heat transfer between parallel plates enclosing rarefied gas by Monte Carlo
Couette flow and heat transfer between parallel plates enclosing hard-sphere rarefied gas analyzed by Monte Carlo method
RAREFIED GAS↗
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Analysis of Couette flow and heat transfer between parallel plates enclosing rarefied gas by Monte Carlo.
Couette flow and heat transfer through hard- sphere rarefied gas enclosed between parallel walls analyzed by Monte Carlo method
MONTE CARLO METHOD↗
Rarefied gas channel flows for three molecular models.
Boltzmann equation for rarefied gas flows between two parallel infinite plates for Maxwellian, hard sphere and BGK models
BOLTZMANN EQUATION↗
Crossed-beam study of the reactive asymmetry of oriented methyl iodide molecules with rubidium
Crossed molecular beam study of reactive asymmetry of oriented methyl iodide molecules reacting with Rb, accounting for observations with hard sphere model
Bernstein, R. B.↗
Part 1: Classical laser. Part 2: The effect of velocity changing collisions on the output of a gas laser
A classical model for laser action is discussed, in which an active medium consisting of anharmonic oscillators interacts with an electromagnetic field in a resonant cavity. Comparison with the case of a medium consisting of harmonic oscillators shows the significance of nonlinearities for producing self-sustained oscillations in the radiation field. A theoretical model is presented for the pressure dependence of the intensity of a gas laser, in which only velocity-changing collisions with foreign gas atoms are included. A collision model for hard sphere, repulsive interactions was derived. Collision theory was applied to a third-order expansion of the polarization in powers of the cavity electric field (weak signal theory).
Borenstein, M.↗
Bernal model - A simple equilibrium theory of close-packed liquids.
The Bernal model of a hard-sphere liquid is used in conjunction with an extension of the cell method to predict the behavior of liquid argon near melting. The entropy of disorder associated with the Bernal state is deduced. The model is found to be applicable to liquid metals.
Caron, L. G.↗
Effect of velocity-changing collisions on the output of a gas laser.
A theoretical model for the pressure dependence of the intensity of a gas laser is presented in which only velocity-changing collisions with foreign-gas atoms are included. This is a special case where the phase shifts are the same for the two atomic-laser levels or are so small that deflections are the dominant effect of collisions. A collision model for hard-sphere repulsive interactions is derived and the collision parameters, persistence of velocity and collision frequency, are assumed to be independent of velocity. The collision theory is applied to a third-order expansion of the polarization in powers of the cavity electric field (weak-signal theory). The resulting expression for the intensity shows strong pressure dependence. The collisions reduce the amount of saturation and the laser intensity increases with pressure in a characteristic fashion.
Borenstein, M.↗
Conduction in fully ionized liquid metals
Electron transport is considered in high density fully ionized liquid metals. Ionic structure is described in terms of hard-sphere correlation functions and the scattering is determined from self-consistently screened point ions. Applications to the physical properties of the deep interior of Jupiter are briefly considered.
Stevenson, D. J.↗
Conduction in fully ionized liquid metals
Electron transport is considered in high-density fully ionized liquid metals. Ionic structure is described in terms of hard-sphere-correlation functions and the scattering is determined from self-consistently screened point ions. Applications to the physical properties of the deep interior of Jupiter are briefly considered.
Stevenson, D. J.↗
Evaluation of approximate relations for Delta /Q/ using a numerical solution of the Boltzmann equation
Data obtained from a numerical solution of the Boltzmann equation for shock-wave structure are used to test the accuracy of accepted approximate expressions for the two moments of the collision integral Delta (Q) for general intermolecular potentials in systems with a large translational nonequilibrium. The accuracy of the numerical scheme is established by comparison of the numerical results with exact expressions in the case of Maxwell molecules. They are then used in the case of hard-sphere molecules, which are the furthest-removed inverse power potential from the Maxwell molecule; and the accuracy of the approximate expressions in this domain is gauged. A number of approximate solutions are judged in this manner, and the general advantages of the numerical approach in itself are considered.
Nathenson, M.↗
Thermodynamics and phase separation of dense fully-ionized hydrogen-helium fluid mixtures
The free energy of a hydrogen-helium fluid mixture is evaluated for the temperatures and densities appropriate to the deep interior of a giant planet such as Jupiter. The electrons are assumed to be fully pressure-ionized and degenerate. In this regime, an appropriate first approximation to the ionic distribution functions can be found by assuming hard sphere interactions. Corrections to this approximation are incorporated by means of the perturbation theory of Anderson and Chandler. Approximations for the three-body interactions and the nonlinear response of the electron gas to the ions are included. It is predicted that a hydrogen-helium mixture, containing 10% by number of helium ions, separates into hydrogen-rich and helium-rich phases below about 8000 K, at the pressures relevant to Jupiter (4-40 Megabars). It is also predicted that the alloy occupies less volume per ion than the separated phases. The equations of state and other thermodynamic derivatives are tabulated. Implications of these results are discussed.
Stevenson, D. J.↗
Some improvements in DNA interaction calculations
Calculations are made on specific DNA-type complexes using refined expressions for electrostatic and polarization energies. Dispersion and repulsive terms are included in the evaluation of the total interaction energy. It is shown that the expansion of the electrostatic potential to include multipole moments up to octopole is necessary to achieve convergence of first-order energies. Polarization energies are not as sensitive to this expansion. The calculations also support the usefulness of the hard sphere model for DNA hydrogen bonds and indicate how stacking interactions are influenced by second-order energies.
Egan, J. T.↗
Partition function corrections
The vibration-rotation interaction coupling in diatomic molecules is analyzed and first-order expressions for the energy levels are deduced. Corrections to the partition function to account for this coupling are derived. The effects of long-range intermolecular forces due to induced dipole-induced dipole interactions, dipole-induced dipole interactions, charge-dipole interactions, and charge-charge interactions are considered. London's quantized oscillator model of the induced dipole-induced dipole interaction is developed. The partition function including effects of such dispersion forces is derived and is shown to lead to the virial equation of state. For a model combining the hard sphere and long-range attractive type potentials, this is found to lead to the van der Waals equation of state. The equation of state near the critical point is presented in reduced form (thermodynamic variables expressed in units of critical point values). Finally, approximate corrections to the electronic partition functions are derived to account for perturbations of excited electronic states induced by neighboring neutral particles, heavy ions, and fast electron collisions.
Source record↗
Thermodynamics of Thomas-Fermi screened Coulomb systems
We obtain in closed analytic form, estimates for the thermodynamic properties of classical fluids with pair potentials of Yukawa type, with special reference to dense fully ionized plasmas with Thomas-Fermi or Debye-Hueckel screening. We further generalize the hard-sphere perturbative approach used for similarly screened two-component mixtures, and demonstrate phase separation in this simple model of a liquid mixture of metallic helium and hydrogen.
Firey, B.↗
Applications of liquid state physics to the earth's core
New results derived for application to the earth's outer core using the modern theory of liquids and the hard-sphere model of liquid structure are presented. An expression derived in terms of the incompressibility and pressure is valid for a high-pressure liquid near its melting point, provided that the pressure is derived from a strongly repulsive pair potential; a relation derived between the melting point and density leads to a melting curve law of essentially the same form as Lindemann's law. Finally, it is shown that the 'core paradox' of Higgins and Kennedy (1971) can occur only if the Gruneisen parameter is smaller than 2/3, and this constant is larger than this value in any liquid for which the pair potential is strongly repulsive.
Stevenson, D. J.↗
Statistical mechanics of light elements at high pressure. VI - Liquid-state calculations with Thomas-Fermi-Dirac theory
A model free energy is developed for hydrogen-helium mixtures based on solid-state Thomas-Fermi-Dirac calculations at pressures relevant to the interiors of giant planets. Using a model potential similar to that for a two-component plasma, effective charges for the nuclei (which are in general smaller than the actual charges because of screening effects) are parameterized, being constrained by calculations at a number of densities, compositions, and lattice structures. These model potentials are then used to compute the equilibrium properties of H-He fluids using a charged hard-sphere model. The results find critical temperatures of about 0 K, 500 K, and 1500 K, for pressures of 10, 100, and 1000 Mbar, respectively. These phase separation temperatures are considerably lower (approximately 6,000-10,000 K) than those found from calculations using free electron perturbation theory, and suggest that H-He solutions should be stable against phase separation in the metallic zones of Jupiter and Saturn.
Macfarlane, J. J.↗
Thermodynamic properties of liquid Si and Ge
Thermodynamic properties of liquid Si and Ge are calculated using standard variational techniques, with the hard-sphere system as a reference system. Third-order electron-ion pseudopotential contributions are included nonvariationally and are shown to have little effect on the free energy, although a larger one on the derivatives of the free energy. Two different model pseudopotentials are used and give similar results in good agreement with experiment.
Shih, W.-H.↗
Wake shield
Progress on the modeling of the flow field around a wake shield using a recently obtained code based on the Monte Carlo method is discussed. The direct simulation Monte Carlo method is a method for solving the Boltzman Equation using an approximation to the collision integral term. The collision integrand is evaluated for randomly selected values of its arguments and the summation will approach the integral for large enough samples. The collision effects may be modeled for either hard sphere or various power law potentials. The convective side of the Boltzman equation is approximated over a time step using a simple trajectory calculation of molecules as they travel through the domain of interest.
Bannister, Tommy↗