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NASA NTRS1978

On the development of packets of surface gravity waves moving over an uneven bottom

The object of study is the evolution of packets of gravity waves moving over variable depth, in particular, the transformation of packets moving into a shelf of increased or decreased depth. The variable-coefficient nonlinear Schroedinger equation with inhomogeneous term is derived for gravity waves moving over an uneven bottom. A solution for an envelope-hole soliton moving over variable depth is obtained when the amplitude-length ratio of the soliton is small. For the shelf problem, it is shown that the first soliton on the shelf will be the one with smallest depression, and the last will have greatest depression. This is in contrast to Korteweg-de Vries soliton fission.

Djordjevic, V. D.↗

NASA NTRS1979

Proton collisional excitation in the lowest lying 3P terms of ions in the Be and Mg isoelectronic sequences

Proton collisional excitation cross sections and rate constants are presented for transitions between the 3P(J) fine-structure levels of the lowest-lying sp configurations in a number of astrophysically important ions belonging to the Be and Mg isoelectronic sequences. The calculations were made by direct integration of the Schroedinger equation resulting from semiclassical Coulomb excitation theory. The cross sections and rate constants for the 3P(J) transitions in the lowest-lying P(2) configurations are expected to be similar to those for the corresponding sp configuration transitions, and this is illustrated for C III. For the high-temperature ion Ca XVII alpha particle excitation is shown to be unimportant for situations involving ordinary values of the He/H abundance ratio. A simple, but apparently accurate method for determining certain radial integrals for low-lying excited configurations is proposed.

Landman, D. A.↗

NASA NTRS1979

Dominant partition method

By use of the L'Huillier, Redish, and Tandy (LRT) wave function formalism, a partially connected method, the dominant partition method (DPM) is developed for obtaining few body reductions of the many body problem in the LRT and Bencze, Redish, and Sloan (BRS) formalisms. The DPM maps the many body problem to a fewer body one by using the criterion that the truncated formalism must be such that consistency with the full Schroedinger equation is preserved. The DPM is based on a class of new forms for the irreducible cluster potential, which is introduced in the LRT formalism. Connectivity is maintained with respect to all partitions containing a given partition, which is referred to as the dominant partition. Degrees of freedom corresponding to the breakup of one or more of the clusters of the dominant partition are treated in a disconnected manner. This approach for simplifying the complicated BRS equations is appropriate for physical problems where a few body reaction mechanism prevails.

Dixon, R. M.↗

NASA NTRS1981

Chaotic /strange/ and periodic behavior in instability saturation by the oscillating two-stream instability

The nonlinear Schroedinger equation with linear growth and damping is truncated to three waves. The resulting system of nonlinear ordinary differential equations describes the excitation of linearly damped waves by the oscillating two-stream instability driven by a linearly unstable pump wave. This system represents a simple model for the nonlinear saturation of a linearly unstable wave. The model is examined analytically and numerically as a function of the dimensionless parameters of the system. It is found that the model can exhibit a wealth of characteristic dynamical behavior including stationary equilibria, Hopf bifurcations to periodic orbits, period doubling bifurcations, chaotic solutions characteristic of a strange attractor, tangent bifurcations from chaotic to periodic solutions, transient chaos, and hysteresis. Many of these features are shown to be explainable on the basis of one-dimensional maps. In the case of chaotic solutions, evidence for the presence of a strange attractor is provided by demonstrating Cantor set-like structure (i.e., scale invariance) in the surface of section.

Russell, D. A.↗

NASA NTRS1981

Vibration-rotation intensities of SiO

Dipole moment matrix elements have been computed for a large number of transitions of astrophysical interest for the more abundant isotopes of SiO. The wave functions utilized were obtained from a direct solution of the Schroedinger equation with an accurate RKR potential. The dipole moment function, in the form of a Pade approximant, was chosen to reproduce the experimental measurements near equilibrium, to have the proper united and separated atom limits, and to have the correct long-range asymptotic dependence on internuclear separation. Because of the large number of transitions involved, and to facilitate applications, the squares of the dipole moment matrix elements were fitted by a least-squares procedure to polynomials in v and J. In addition, Einstein A coefficients are given for observed maser transitions and for selected vibrational bands. These latter are compared with previous calculations, and it is concluded that for the higher Delta v transitions, the present results represent a significant improvement.

Tipping, R. H.↗

NASA NTRS1982

Level shifts and inelastic electron scattering in dense plasmas

A completely quantum mechanical formalism has been developed to describe the high density plasma effects on fundamental atomic parameters. Both the bound and free electrons are treated by a method which in principle is similar to Hartree's self-consistent field method. The free plasma electrons' wavefunction is obtained from the Schroedinger equation with the effective potential representing the spherically averaged Coulomb interaction with bound and free electrons. Results are given for level shifts, coefficients of transition probabilities, and electron collision cross sections of Ne(9+) for temperatures of 200 and 500 eV for an electron density range of 1-6 x 10 to the 24th per cu cm.

Davis, J.↗

NASA NTRS1982

Asymptotic freedom in solids - A theorem

A cusp theorem is proved that relates the zero-separation value and slope of two-particle position correlation functions in quantum many-body systems with Coulombic interactions. The theorem is independent of the particle type and symmetry of the wave function. Its proof uses only the integral form of the Schroedinger equation and the continuity and exponential decay of the wave function. It is used to derive a sum rule for the electron-gas structure factor and an exact statement about the screening of point charges. Applications to atomic-orbital-based calculations for H2 and metallic H are described.

Carlsson, A. E.↗

NASA NTRS1984

Chemical application of diffusion quantum Monte Carlo

The diffusion quantum Monte Carlo (QMC) method gives a stochastic solution to the Schroedinger equation. This approach is receiving increasing attention in chemical applications as a result of its high accuracy. However, reducing statistical uncertainty remains a priority because chemical effects are often obtained as small differences of large numbers. As an example, the single-triplet splitting of the energy of the methylene molecule CH sub 2 is given. The QMC algorithm was implemented on the CYBER 205, first as a direct transcription of the algorithm running on the VAX 11/780, and second by explicitly writing vector code for all loops longer than a crossover length C. The speed of the codes relative to one another as a function of C, and relative to the VAX, are discussed. The computational time dependence obtained versus the number of basis functions is discussed and this is compared with that obtained from traditional quantum chemistry codes and that obtained from traditional computer architectures.

Reynolds, P. J.↗

NASA NTRS1983

Weak cubic Langmuir turbulence

The cubically nonlinear Schroedinger equation model of Langmuir turbulence is solved in the weak turbulence limit. Steady-state power-law solutions for the energy spectra are found in arbitrary dimensionality. In one spatial dimension, the theory incorrectly predicts that no spectrum evolves in time. In three spatial dimensions, numerical solutions are obtained for the undriven, undamped, initial value problem and for the driven, damped, initial value problem.

Hansen, P. J.↗

NASA NTRS1983

Self-modulational formation of pulsar microstructures

A nonlinear plasma theory for self-modulation of pulsar radio pulses is discussed. A nonlinear Schroedinger equation is derived for strong electromagnetic waves propagating in an electron-positron plasma. The nonlinearities arising from wave-intensity-induced particle-mass variation may excite the modulational instability of circularly and linearly polarized pulsar radiation. The resulting wave envelopes can take the form of periodic wave trains or solitons. These nonlinear stationary waveforms may account for the formation of pulsar microstructures.

Chian, A. C.-L.↗

NASA NTRS1984

On the Kelvin-Helmholtz instabilities of supersonic shear layers

Analytical consideration is given to a Kelvin-Helmholtz instability in a finite width supersonic shear layer with linear and sinusoidal velocity profiles in the transition region. An analogy is explored between the pressure perturbation and the bound and scattering wave states of the one-dimensional Schroedinger equation. A numerical model is obtained for generating contour maps of the real and imaginary parts of the perturbation frequency in the (A,B)-plane. A comparison is made between the numerical results and analytical expressions derived for very small Mach numbers. Two unstable regimes are characterized in the (A,B)-plane. The method is concluded useful for both laboratory and astrophysics problems.

Choudhury, S. R.↗

NASA NTRS1984

A variational method for the calculation of dynamic polarizabilities and two-photon transition moments - The dressed molecule approach

The solution of the time-dependent Schroedinger equation of the molecule + radiation field system is analyzed. A quantized radiation field is used. The relationship between the oscillatory wave function and the dressed state wave function is established, the oscillatory wave function being the solution if the radiation field is turned on at t = 0 and the dressed state being the stationary solution satisfying the boundary condition only if the field is present at t = negative infinity. In general, the oscillatory wave function can be expressed using a complete set of dressed states. However, in the presence of a nonresonant radiation field, the system is well represented by a single dressed state. Molecular properties such as dynamic polarizabilities and two-photon transition moments can be deduced from the dressed state wave function instead of the oscillatory wave function as in previous methods. Because of its stationary character, the dressed state is more amenable to approximate calculations. A CI method is developed for this purpose. The CI matrix is simple in form and can be readily constructed using existing computer codes. The present method can also be adapted to calculate other optical properties.

Huo, W. M.↗

NASA NTRS1985

Formation of ion acoustic solitary waves upstream of the earth's bow shock

The turbulent plasma development of Lee and Parks is applied to the solar wind approaching the earth's bow shock region. The ponderomotive force contribution is due to ion acoustic waves propagating in the direction of the ambient magnetic field. In this case, the envelope of the ion acoustic wave is shown to satisfy the cubic Schroedinger equation. Modulational instabilities exist for waves in the solar wind, thereby predicting the generation of solitary waves. This analysis further identifies that the ion acoustic waves which exhibit this instability have short wavelengths.

Pangia, M. J.↗

NASA NTRS1985

Modulational development of nonlinear gravity-wave groups

Observations of the development of nonlinear surface gravity-wave groups are presented, and the amplitude and phase modulations are calculated using Hilbert-transform techniques. With increasing propagation distance and wave steepness, the phase modulation develops local phase reversals whose locations correspond to amplitude minima or nodes. The concomitant frequency modulation develops jumps or discontinuities. The observations are compared with recent similar results for wavetrains. The observations are modelled numerically using the cubic nonlinear Schroedinger equation. The motivation is twofold: to examine quantitatively the evolution of phase as well as amplitude modulation, and to test the inviscid predictions for the asymptotic behavior of groups versus long-time observations. Although dissipation rules out the recurrence, there is a long-time coherence of the groups. The phase modulation is found to distinguish between dispersive and soliton behavior.

Chereskin, T. K.↗

NASA NTRS1985

Statistical theory of cubic Langmuir turbulence

The cubic direct-interaction approximation is applied to the truncated cubically nonlinear Schroedinger equation. The statistical theory does a satisfactory job in several important respects.

Sun, G.-Z.↗

NASA NTRS1985

Statistical theory of cubic Langmuir turbulence

The cubic direct interaction approximation is applied to a truncated (in Fourier space) version of the cubically nonlinear Schroedinger equation model of Langmuir physics. The results are compared (in the three-mode case) to those for an ensemble of numerical solutions of the dynamical equations with 10,000 different sets of Gaussianly distributed initial conditions. In the undriven, undamped case, the statistical theory (but not the ensemble) evolves to a state of thermal equilibrium. In the driven, damped case, the statistical theory appears to evolve to a state close to that corresponding to one of the limit cycles of the dynamical equations.

Sun, G.-Z.↗

NASA NTRS1986

Theoretical and material studies on thin-film electroluminescent devices

A theoretical study of resonant tunneling in multilayered heterostructures is presented based on an exact solution of the Schroedinger equation under the application of a constant electric field. By use of the transfer matrix approach, the transmissivity of the structure is determined as a function of the incident electron energy. The approach presented is easily extended to many layer structures where it is more accurate than other existing transfer matrix or WKB models. The transmission resonances are compared to the bound state energies calculated for a finite square well under bias using either an asymmetric square well model or the exact solution of an infinite square well under the application of an electric field. The results show good agreement with other existing models as well as with the bound state energies. The calculations were then applied to a new superlattice structure, the variablly spaced superlattice energy filter, (VSSEP) which is designed such that under bias the spatial quantization levels fully align. Based on these calculations, a new class of resonant tunneling superlattice devices can be designed.

Summers, C. J.↗

NASA NTRS1986

Statistical approach to cubic Langmuir turbulence

Previous work on the cubic direct interaction approximation applied to the truncated (in Fourier space) cubically nonlinear Schroedinger equation model of Langmuir turbulence is extended to more modes. In the undriven, undamped case, excellent agreement between the statistical theory and a numerical ensemble of solutions of the dynamic equations is obtained. In the driven, damped case, satisfactory agreement is obtained provided the dynamic ensemble is limited to initial conditions in the basin of attraction.

Sun, G.-Z.↗