Big Chemical Encyclopedia

Chemical substances, components, reactions, process design ...

Articles Figures Tables About

Dirac function linear

CALCULATION OF THE ELECTRONIC STRUCTURE OF ANTIFERROMAGNETIC CHROMIUM WITH A SINUSOIDAL SPIN DENSITY WAVE BY THE METHOD OF DIRAC FUNCTION LINEAR COMBINATION... [Pg.139]

We consider the linear source q x, y) = h y) 6 x). Here (5(x) is a Dirac function and h y) is a sufficiently smooth function. Then problem (1) can be reduced to the following problem in a half-plane... [Pg.68]

In the relativistic KKR method the trial function inside the MT-sphere is chosen as a linear combination of solutions of the Dirac equation in the center-symmetrical field with variational coefficients C7 (k)... [Pg.141]

This section introduces the basic mathematics of linear vector spaces as an alternative conceptual scheme for quantum-mechanical wave functions. The concept of vector spaces was developed before quantum mechanics, but Dirac applied it to wave functions and introduced a particularly useful and widely accepted notation. Much of the literature on quantum mechanics uses Dirac s ideas and notation. [Pg.80]

A set of complete orthonormal functions ipfx) of a single variable x may be regarded as the basis vectors of a linear vector space of either finite or infinite dimensions, depending on whether the complete set contains a finite or infinite number of members. The situation is analogous to three-dimensional cartesian space formed by three orthogonal unit vectors. In quantum mechanics we usually (see Section 7.2 for an exception) encounter complete sets with an infinite number of members and, therefore, are usually concerned with linear vector spaces of infinite dimensionality. Such a linear vector space is called a Hilbert space. The functions ffx) used as the basis vectors may constitute a discrete set or a continuous set. While a vector space composed of a discrete set of basis vectors is easier to visualize (even if the space is of infinite dimensionality) than one composed of a continuous set, there is no mathematical reason to exclude continuous basis vectors from the concept of Hilbert space. In Dirac notation, the basis vectors in Hilbert space are called ket vectors or just kets and are represented by the symbol tpi) or sometimes simply by /). These ket vectors determine a ket space. [Pg.80]

Dirac delta function in three dimensions extension rate extensional strain strain tensor (linear)... [Pg.198]

The RQDO radial, scalar, equation derives from a non-unitary decoupling of Dirac s second order radial equation. The analytical solutions, RQDO orbitals, are linear combinations of the large and small components of Dirac radial function [6,7] ... [Pg.52]

The log-normal function is unique and does not deserve modification. It occupies a unique position in both botany and biology that is critically related to the processes involved in growth. There are four major classes of statistics of interest in vision. They are the normal, the log-normal, the Stefan-Boltzmann and the Fermi-Dirac statistics. The first is often spoken of as Gaussian Statistics. It relies on a totally random series of outcomes in a linear numerical space. Log-normal statistics rely on a totally random series of outcomes in a logarithmic space. This space is the logarithm of the linear space of Gaussian Statistics. The Stefan-Boltzmann class of statistics apply directly to totally random events constrained in their total energy. They explain the thermal radiation from a physical body. The Fermi-Dirac Statistics are also known as quantum-mechanical statistics. Fermi-Dirac Statistics represent totally random events constrained as to the amplitude of a specific outcome. While Fermi-... [Pg.86]

When extended to include electronic correlation, for which an exact but implicit orbital functional was derived above, the TDHF formalism becomes a formally exact theory of linear response. In practice, some simplified orbital functional Ec[ 4>i ] must be used, and the accuracy of results is limited by this choice. The Hartree-Fock operator Ti is replaced by G = Ti + vc. Dirac defines an idempo-tent density operator p whose kernel is JA i(r) i (r/)- The Did. equations are equivalent to [0, p] = 0. The corresponding time-dependent equations are itijtP = [Q(t), p(t)]. Dirac proved, for Hermitian G, (hat the time-dependent equation ih i(rt) implies that p(l) is idempotent. Hence pit) corresponds to a normalized time-dependent reference state. [Pg.84]

This proposition has been tested in the exact-exchange limit of the implied linear-response theory [329], The TDFT exchange response kernel disagrees qualitatively with the corresponding expression in Dirac s TDHF theory [79,289]. This can be taken as evidence that an exact local exchange potential does not exist in the form of a Frechet derivative of the exchange energy functional in TDFT theory. [Pg.89]

Since a and 3 are represented by 4 x 4 matrices, the wave function / must also be a four-component function and the Dirac wave equation (3.9) is actually equivalent to four simultaneous first-order partial differential equations which are linear and homogeneous in the four components of P. According to the Pauli spin theory, introduced in the previous chapter, the spin of the electron requires the wave function to have only two components. We shall see in the next section that the wave equation (3.9) actually has two solutions corresponding to states of positive energy, and two corresponding to states of negative energy. The two solutions in each case correspond to the spin components. [Pg.76]


See other pages where Dirac function linear is mentioned: [Pg.524]    [Pg.524]    [Pg.328]    [Pg.80]    [Pg.387]    [Pg.201]    [Pg.498]    [Pg.225]    [Pg.409]    [Pg.641]    [Pg.158]    [Pg.286]    [Pg.161]    [Pg.139]    [Pg.23]    [Pg.369]    [Pg.439]    [Pg.258]    [Pg.258]    [Pg.239]    [Pg.30]    [Pg.196]    [Pg.94]    [Pg.218]    [Pg.91]    [Pg.91]    [Pg.299]    [Pg.36]    [Pg.94]    [Pg.86]    [Pg.305]    [Pg.262]    [Pg.155]    [Pg.93]    [Pg.323]   


SEARCH



Dirac function

Linear functional

Linear functionals

Linear functions

© 2024 chempedia.info