相关论文: Distorted Waves with Exact Non-Local Exchange: a C…
We study the Cauchy problem for the one-dimensional wave equation with an inverse square potential. We derive dispersive estimates, energy estimates, and estimates involving the scaling vector field, where the latter are obtained by…
We calculate the electronic wave-function for a phosphorus donor in silicon by numerical diagonalisation of the donor Hamiltonian in the basis of the pure crystal Bloch functions. The Hamiltonian is calculated at discrete points localised…
The systematic underestimation of band gaps is one of the most fundamental challenges in semilocal density functional theory (DFT). In addition to hindering the application of DFT to predicting electronic properties, the band gap problem is…
The traditional method of teaching canonical transformations involves the introduction of generating functions of various types. This method obscures the underlying structure of the Hamiltonian least-action principle, and can make a…
We present a new math-physics modeling approach, called canonical quantization with numerical mode-decomposition, for capturing the physics of how incoming photons interact with finite-sized dispersive media, which is not describable by the…
One method for the numerical treatment of future null-infinity is to decouple coordinates from the tensor basis and choose each in a careful manner. This dual-frame approach is hampered by logarithmically divergent terms that appear in a…
The problem of the harmonic oscillator with a centrally located delta function potential can be exactly solved in one dimension where the eigenfunctions are expressed as superpositions of the Hermite polynomials or as confluent…
This report presents a new approach for treating the coupling of electrons and nuclei in quantum mechanical calculations for molecules and condensed matter. It includes the standard "Born-Oppenheimer approximation" as a special case but…
A review of some recently developed methods of calculating multiple differential cross-sections of photoionization and electron impactionization of atoms and molecules having two active electrons is presented. The methods imply original…
We are concerned with rigorous mathematical analysis of shock diffraction by two-dimensional convex cornered wedges in compressible fluid flow governed by the nonlinear wave system. This shock diffraction problem can be formulated as a…
We propose a generalized finite element method for the strongly damped wave equation with highly varying coefficients. The proposed method is based on the localized orthogonal decomposition introduced and is designed to handle independent…
We develop a new envelope-function formalism to describe electrons in slowly-varying inhomogeneously strained semiconductor crystals. A coordinate transformation is used to map a deformed crystal back to geometrically undeformed structure…
This paper discusses the solutions to the perturbed wave equation containing a singular potential term in the Lorentzian metric. We present the classical solution to the problem using the separation of variables method for any dimension, n.…
We show how several important classical problems, with positive definite potential energy, can be solved by starting from the factorization of the total mechanical energy using complex numbers. In particular, we derive in a new way exact…
A recently developed method has been extended to a nonlocal equation arising in steady water wave propagation in two dimensions. We obtain analyic approximation of steady water wave solution in two dimensions with rigorous error bounds for…
A flow decomposition method based on canonical correlation analysis is proposed in this paper to optimally dissect complex flows into mutually orthogonal modes that are ranked by their cross-correlation with an observable. It is…
The equation is considered for a composite scalar particle with polarizabilities in an external quantized electromagnetic plane wave. This equation is reduced to a system of equations for infinite number of interacting oscillators. After…
A new algorithm is presented to find exact traveling wave solutions of differential-difference equations in terms of tanh functions. For systems with parameters, the algorithm determines the conditions on the parameters so that the…
Distorted plane waves, sometimes called Eisenstein functions, are a family of eigenfunctions of a Schr\"odinger operator that are not square integrable. More precisely, they can be written as the sum of a plane wave and an outgoing wave. We…
The non-relativistic static and dynamic dipole polarizabilities of hydrogen atom experiencing a cylindrical confinement are investigated. Two methods based on B-Splines are used for the computations of the energies and wavefunctions. The…