SEARCH · Engineering Papers
Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.
Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.
We have recently estimated the total energy of the BeH 2 molecule as -15.918 ± 0.015 au. One of the steps in the analysis was to estimate the difference between the SCF energies computed with a minimal basis set of Slater orbits and with the best possible single-determinant wave function, the so-called Hartree-Fock limit and was predicted to be -15.773 ± 0.007 au for BeH 2 .
The existence of gaseous BeH 2 , predicted from simple valence theory, has still not been established experimentally. We have estimated the total energy of this molecule, assumed linear symmetric, as the sum of four negative terms; the calculated SCF energy, the SCF error to the Hartree-Fock limit, the correlation energy to the exact nonrelativistic energy, and the relativistic energy.
An analytical theory of nonlinear neutralization waves generated by injection of electrons from a grid in the direction of a homogeneous ion beam of uniform velocity and infinite extension is presented. The electrons are assumed to interact with the ions through the self-consistent space charge field and by strong collective interactions, while diffusion in the pressure gradient is disregarded (zero-temperature approximation). The associated nonlinear boundary-value problem is solved in closed form by means of a von Mises transformation. It is shown that the electron gas moves into the ion space in the form of a discontinuous neutralization wave, which exhibits a periodic field structure (incomplete neutralization). This periodic wave structure is damped out by intercomponent momentum transfer - i.e., after a few relaxation lengths a quasi-neutral plasma results.
Use of microscopic detail in random walk theory describing the initial formations of a large number of avalanches shows that concomitant electron transport coefficients quickly relax to equilibrium values. This enables the use of random walks having step sizes and probabilities based only on local electric field strengths and densities. A self-consistent avalanche solution which accounts for collective long range Coulomb interactions as well as short range elastic and inelastic collisions between electrons and background atoms is demonstrated for helium. Avalanche growth retardation followed by an abrupt growth augmentation as time proceeds is shown to be associated with the formation of regions of charge density extrema near the avalanche axis and within the axial distance covered by the electron swarm.
Reiterative method for determining boundary shape between plasma and magnetic field
A theory of ion-wave current instabilities which takes into account, in a self-consistent manner, the inhomogeneities generated by field-aligned currents in a collisionless plasma is presented. Diamagnetic current associated with the current-produced density gradient is included in the distribution. The theory predicts that for a given frequency, the current threshold for ion-wave current instabilities is, in general, much below the threshold of ion acoustic instability in a uniform plasma as given by Fried and Gould. The current threshold is essentially zero in the limit when the ion Landau damping effect is negligible, or equivalently, the ion-wave current instabilities are absolute if there are no limitations on the wavelength. This is true even in the absence of externally applied density gradients in contrast to Kadomtsev's drift-wave results. For dimensions of interest in laboratory plasmas, the predicted linear growth rate increases with increasing longitudinal wavelength and with decreasing wavelength parallel to the diamagnetic current. Under the conditions of an experiment on anomalous resistivity (the dimensions but not the geometry of the machine have been considered), there is good agreement between the predicted onset of ion-wave current instabilities and the experimental data on the onset of anomalous resistivity.
Electric fields and electron work functions, surface potentials and number density distributions in selected metals surfaces determined using free electron model
Electron work functions, surface potentials, and electron number density distributions and electric fields in the surface region of 26 metals were calculated from first principles within the free electron model. Calculation proceeded from an expression of the total energy as a functional of the electron number density, including exchange and correlation energies, as well as a first inhomogeneity term. The self-consistent solution was obtained via a variational procedure. Surface barriers were due principally to many-body effects; dipole barriers were small only for some alkali metals, becoming quite large for the transition metals. Surface energies were inadequately described by this model, which neglects atomistic effects. Reasonable results were obtained for electron work functions and surface potential characteristics, maximum electron densities varying by a factor of over 60.
A simple version of the semiclassical theory is applied to the shot effect. Considerations of thermal noise reported by Lamb (1965) are extended to take into account amplitude fluctuations. The laser is considered to be a lossy cavity of the Fabry-Perot type in single-mode operation with a circular frequency driven by an inverted population of active atoms. The electric field is taken to be transverse to the cavity axis. The amplitude and phase are assumed to be slowly varying functions which satisfy two self-consistency equations.
An objection to the effect that the first-order orbitals describing the perturbation of Hartree-Fock or X-alpha closed shell atoms by a multipole electric field may not have the required symmetry properties is acknowledged and answered. It is shown that the assumption of the expected symmetry is a self-consistent one.
A self-consistent tail current sheet model described by an exact analytic solution of the time-independent Vlasov-Maxwell equations is presented. The model has a 'slingshot' field configuration with field lines outside the plasma sheet slightly flared in the antisolar direction. It is pointed out that when the model parameters are adjusted to agree with the spatial variation along the tail the required thickness of the neutral sheet must be about 2.5 earth radii, instead of less than or equal to 1 earth radius, as indicated by observations. Furthermore, it is shown qualitatively that a considerable velocity shear must be present in the tail current sheet if the plasma sheet is indeed much thicker than the neutral sheet.
Formulation of a self-consistent convective nonlinear theory of type I irregularities in the equatorial electrojet. It is found that a combination of three mechanisms - convective amplification, quasi-linear polarization electric field reduction, and nonlinear particle orbit diffusion damping - accounts for radar backscatter observations of a ubiquitous marginally stable (or 'constant ion-acoustic Doppler shift') saturation spectrum better than any of the three mechanisms treated separately. In particular, no spatially homogeneous theory without wave refraction can account for the observations. Wave refraction alone or with quasi-linear polarization electric field reduction is also inadequate. Wave refraction, quasi-linear polarization reduction, and particle orbit diffusion theory appear to account for type I observations at radar elevation angles less than 60 deg. Vertical type I backscatter cannot be explained without modifying the present laminar electrojet model.
A wave-function-dependent four-vector potential is added to the Dirac equation in order to achieve conservation of energy and momentum for a Dirac electron and its emitted electromagnetic field. The resultant equation contains solutions which describe transitions between different energy states of the electron. As a consequence it is possible to follow the space-time evolution of such a process. This evolution is shown in the case of the spontaneous emission of an electromagnetic field by an electron bound in a hydrogen-like atom. The intensity of the radiation and the spectral distribution are calculated for transitions between two eigenstates. The theory gives a self-consistent deterministic description of some simple radiation processes without using quantum electrodynamics or the correspondence principle.
A computer model is developed using infinitely long concentric cylindrical shells to represent the neutral atoms, ions and electrons in the barium cloud. The neutral shells are given a distribution of positions and velocities whose parameters are chosen to be consistent with the dynamics of the release. From this distribution, the ion and electron shells are generated at random using the observed time constant for photoionization. The ion and electron shells thus formed are followed using self-consistent equations of motion. Various averages which could be compared with observation of the actual cloud are calculated at regular time intervals. An unexpected result is the predicted very early return of the magnetic field within the cloud to its ambient value.
Asymmetric amplitude effects between the oppositely directed traveling waves in a He-Ne ring laser are analyzed both theoretically and experimentally. These effects make it possible to detect angular orientations of an inner-cavity bar with respect to the plane of the ring cavity. The amplitude asymmetries occur when a birefringent bar is placed in the three-mirror ring cavity, and an axial magnetic field is applied to the active medium. A simplified theoretical analysis is performed by using a first order perturbation theory to derive an expression for the polarization of the active medium, and a set of self-consistent equations are derived to predict threshold conditions. Polarization asymmetries between the oppositely directed waves are also predicted. Amplitude asymmetries similar in nature to those predicted at threshold occur when the laser is operating in 12-15 free-running modes, and polarization asymmetry occurs simultaneously.
A self-consistent avalanche solution which accounts for collective long range Coulomb interactions as well as short range elastic and inelastic collisions between electrons and background atoms is made possible by a random walk technique. Results show that the electric field patterns in the early formation stages of avalanches in helium are close to those obtained from theory based on constant transport coefficients. Regions of maximum and minimum induced electrostatic potential phi are located on the axis of symmetry and within the volume covered by the electron swarm. As formation time continues, however, the region of minimum phi moves to slightly higher radii and the electric field between the extrema becomes somewhat erratic. In the intermediate formation periods the avalanche growth is slightly retarded by the high concentration of ions in the tail which oppose the external electric field. Eventually the formation of ions and electrons in the localized regions of high field strength more than offset this effect causing a very abrupt increase in avalanche growth.
The initial expansion of a barium ion cloud release in the distant earth's magnetosphere is numerically investigated by means of a computer model with self-consistent electric and magnetic interactions. Initial conditions for the calculations are an expanding neutral cloud that is photoionized with a time constant of 20 sec. The results show that after the first 30 sec, the large fluctuations in the magnetic field and in other parameters are damped out and the magnetic field in the central region of the cloud is reduced to near zero. Also, after only 10 sec, a relatively high central ion density has developed and remains for the duration of the calculations.
The shape of the magnetosphere has been calculated self-consistently for inclinations of the earth's magnetic dipole from perpendicular to the solar wind. Inclination angles of 0-35 deg have been chosen in steps of 5 deg and various smooth trends in the surface characteristics with increasing inclination angle noted. The surface points and the complete field at the surface points have been calculated for the entire surfaces. The neutral point region has been given precise study in one degree steps and is found to be tangent to the solar wind velocity and to have a smooth continuous curvature.