Search results for "fer"

The Complex WKB Method

2019

In this chapter we shall study the exponential growth and asymptotic expansions of exact solutions of second-order differential equations in the semi-classical limit. As an application, we establish a Bohr-Sommerfeld quantization condition for Schrodinger operators with real-analytic complex-valued potentials.

An explicit unconditionally stable numerical solution of the advection problem in irrotational flow fields

2004

[1] A new methodology for the Eulerian numerical solution of the advection problem is proposed. The methodology is based on the conservation of both the zero- and the first-order spatial moments inside each element of the computational domain and leads to the solution of several small systems of ordinary differential equations. Since the systems are solved sequentially (one element after the other), the method can be classified as explicit. The proposed methodology has the following properties: (1) it guarantees local and global mass conservation, (2) it is unconditionally stable, and (3) it applies second-order approximation of the concentration and its fluxes inside each element. Limitati…

Excitation energies and photoabsorption oscillator strengths of the Rydberg series in CF3Cl. A linear response and quantum defect study.

2007

Vertical excitation energies of the CF(3)Cl molecule have been obtained from a response function approach with a CC reference function to determine absolute photoabsorption oscillator strengths in the molecular-adapted quantum defect orbital formalism (MQDO). The present work covers more highly excited Rydberg states than have been experimentally reported. Assessing of the reliability of the present calculations is provided through a comparative analysis between the results of the molecule and the Cl atom. This can be used to allow for predictions of the same type of properties in other analogous systems.

Non-Stationary Probabilistic Response of Linear Systems Under Non-Gaussian Input

1991

The probabilistic characterization of the response of linear systems subjected to non-normal input requires the evaluation of higher order moments than two. In order to obtain the equations governing these moments, in this paper the extension of the Ito’s differential rule for linear systems excited by non-normal delta correlated processes is presented. As an application the case of the delta correlated compound Poisson input process is treated.

Constant inner potential DFT for modelling electrochemical systems under constant potential and bias

2021

Electrochemical interfaces and reactions play a decisive role in e.g. clean energy conversion but understanding their complex chemistry remains an outstanding challenge. Constant potential or grand canonical ensemble (GCE) simulations are indispensable for unraveling the properties of electrochemical processes as a function of the electrode potential. Currently, constant electrode potential calculations at the density functional theory (DFT) level are carried out by fixing the Fermi level of the simulation cell. However, the Fermi level from DFT calculations does does not always reflect the experimentally controlled electrode potential or describe the thermodynamic independent variable in G…

A Method of Conversion of some Coefficient Inverse Parabolic Problems to a Unified Type of Integral-Differential Equation

2011

Coefficient inverse problems are reformulated to a unified integral differential equation. The presented method of conversion of the considered inverse problems to a unified Volterra integral-differential equation gives an opportunity to distribute the acquired results also to analogous inverse problems for non-linear parabolic equations of different types.

High Resolution Coherent Anti-Stokes Raman Spectroscopy (CARS) Of O 2 And CO 2

1988

With the help of high spectral quality (linewidth , 6 MHz) injection-locked flashlamp-pumped dye lasers, high resolution Coherent Anti-Stokes Raman Spectroscopy (CARS) has been applied to the study of the Q-branches of 0 2 and CO 2 . The Q-branch linewidths of 02 were obtained from the first nine transitions (J 2 = 1 to 17) recorded at pressures from 0.094 to 1 atm at room temperature. A least squares program was employed to fit calculated spectra to experimental spectra by adjusting different parameters. The collisional broadening coefficients we have obtained are consistent with available Raman data. We have also studied the Q-branch of the fundamental v1 band of CO 2 in the Fermi resonan…

Synthesis, Characterization of FexZr1-xO2Solid Solution Nanoparticles and Bulk Powders Prepared Using a Sol-Gel Technique

2015

Representation of Stationary Multivariate Gaussian Processes Fractional Differential Approach

2011

In this paper, the fractional spectral moments method (H-FSM) is used to generate stationary Gaussian multivariate processes with assigned power spectral density matrix. To this aim, firstly the N-variate process is expressed as sum of N fully coherent normal random vectors, and then, the representation in terms of HFSM is used.

Non-linear systems under parametric alpha-stable LÉVY WHITE NOISES

2005

In this study stochastic analysis of nonlinear dynamical systems under a-stable, multiplicative white noise has been performed. Analysis has been conducted by means of the Ito rule extended to the case of α-stable noises. In this context the order of increments of Levy process has been evaluated and differential equations ruling the evolutions of statistical moments of either parametrically and external dynamical systems have been obtained. The extended Ito rule has also been used to yield the differential equation ruling the evolution of the characteristic function for parametrically excited dynamical systems. The Fourier transform of the characteristic function, namely the probability den…