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Angular functions definition

These new wave functions are eigenfunctions of the z component of the angular momentum iij = —with eigenvalues = +2,0, —2 in units of h. Thus, Eqs. (D.l 1)-(D.13) represent states in which the vibrational angular momentum of the nuclei about the molecular axis has a definite value. When beating the vibrations as harmonic, there is no reason to prefer them to any other linear combinations that can be obtained from the original basis functions in... [Pg.621]

Using solution (1.37) in definition (1.4), one has the angular momentum correlation function... [Pg.23]

Equations (56) and (57) give six constrains and define the BF-system uniquely. The internal coordinates qk(k = 1,2, , 21) are introduced so that the functions satisfy these equations at any qk- In the present calculations, 6 Cartesian coordinates (xi9,X29,xi8,Xn,X2i,X3i) from the triangle Og — H9 — Oi and 15 Cartesian coordinates of 5 atoms C2,C4,Ce,H3,Hy are taken. These 21 coordinates are denoted as qk- Their explicit numeration is immaterial. Equations (56) and (57) enable us to express the rest of the Cartesian coordinates (x39,X28,X38,r5) in terms of qk. With this definition, x, ( i, ,..., 21) are just linear functions of qk, which is convenient for constructing the metric tensor. Note also that the symmetry of the potential is easily established in terms of these internal coordinates. This naturally reduces the numerical effort to one-half. Constmction of the Hamiltonian for zero total angular momentum J = 0) is now straightforward. First, let us consider the metric. [Pg.123]

A complete decomposition of the ab initio computed CF matrix in irreducible tensor operators (ITOs) and in extended Stevens operators. The parameters of the multiplet-specific CF acting on the ground atomic multiplet of lanthanides, and the decomposition of the CASSCF/RASSI wave functions into functions with definite projections of the total angular momentum on the quantization axis are provided. [Pg.161]

Periodicity in space means that it repeats at regular intervals, known as the wavelength, A. Periodicity in time means that it moves past a fixed point at a steady rate characterised by the period r, which counts the crests passing per unit time. By definition, the velocity v = A/r. It is custom to use the reciprocals of wavelength 1/X — (k/2-ir) or 9, known as the wavenumber (k = wave vector) and 1/t — v, the frequency, or angular frequency u = 2itv. Since a sine or cosine (harmonic) wave repeats at intervals of 2n, it can be described in terms of the function... [Pg.113]

The relationship between different components of orbital angular momentum such as Lz and Lx can be investigated by multiple SG experiments as discussed for electron spin and photon polarization before. The results are in fact no different. This is a consequence of the noncommutativity of the operators Lx and Lz. The two observables cannot be measured simultaneously. While total angular momentum is conserved, the components vary as the applied analyzing field changes. As in the case of spin or polarization, measurement of Lx, for instance, disturbs any previously known value of Lz. The structure of the wave function does not allow Lx to be made definite when Lz has an eigenvalue, and vice versa. [Pg.233]

It is not possible to ascribe a definite value of the orbital angular momentum to a photon state since the vector spherical harmonic YjM may be a function of different values of . This provides the evidence that, strictly speaking, it... [Pg.257]

The function F(l,2) is in fact the space part of the total wave function, since a non-relativistic two-electron wave function can always be represented by a product of the spin and space parts, both having opposite symmetries with respect to the electrons permutations. Thus, one may skip the spin function and use only the space part of the wave function. The only trace that spin leaves is the definite per-mutational symmetry and sign in Eq.(14) refers to singlet as "+" and to triplet as Xi and yi denote cartesian coordinates of the ith electron. A is commonly known angular projection quantum number and A is equal to 0, 1, and 2 for L, II and A symmetry of the electronic state respectively. The linear variational coefficients c, are found by solving the secular equations. The basis functions i(l,2) which possess 2 symmetry are expressed in elliptic coordinates as ... [Pg.177]

While no convincing reasons have been put forward to explain the different behavior of the two photocycloaddiicts derived from 5-fluorouracil, the elimination process is definitely favored by the presence of a methoxy group, and even more so with a ge/M-dimethoxy functions [72], Such a methoxy donor would confer acceptor character to the angular hydrogen. ... [Pg.98]

Figure 25.7 Nondimensional attenuation coefficient, a, and 10-1 specific phase shift, P, for sinusoidal input into a saturated groundwater system as a function 10 2 of the Peclet Number Pe. The numbers attributed to the different 1 q 3 lines give the nondimensional angular frequency 2. See text for definitions. 10-4... Figure 25.7 Nondimensional attenuation coefficient, a, and 10-1 specific phase shift, P, for sinusoidal input into a saturated groundwater system as a function 10 2 of the Peclet Number Pe. The numbers attributed to the different 1 q 3 lines give the nondimensional angular frequency 2. See text for definitions. 10-4...
We note that in the definition of moments, we have used frequency v in units of cm-1. Other units of frequency are sometimes chosen instead of the experimentalist s standard use of frequency in wavenumber units (cm-1), angular frequencies co = 2ncv are the most likely choice of theorists, which leads to different dimensions of the moments, and to the appearence of factors like powers of 2nc. We note, moreover, that in the early days of collisional induction studies the zeroth moment yo was defined without the hyperbolic cotangens function, Eqs. 5.6. For the vibrational bands (hco 3> kT), the old and new definitions are practically identical. However, for the ro to translational band substantial differences exist. The old definition of yo was never intended to be used for the far infrared [314] only Eq. 5.6 gives total intensity in that case. [Pg.200]

The functions (6.94) are the linear combinations of (6.84) that correspond to definite values of the vibrational angular momentum the absolute value of the vibrational angular momentum about the molecular axis is Ih. [Pg.142]

A PWC function is defined as an (N — l)-electron bound parent state (atom or ion) with well-defined spin, parity, angular momentum and energy Ia = (Sa, na, La, Ea), coupled first to the spin-angular part of a single-particle state for the Nth electron, with definite orbital angular momentum la, to form a state with definite parity n, spin S, angular momentum L, and their projections L and M (for brevity, we indicate these global quantum numbers with the collective index T)... [Pg.286]

Theoretically, the radius of an ion extends from the nucleus to the outermost orbital occupied by electrons. The very nature of the angular wave function of an electron, which approaches zero asymptotically with increasing distance from the nucleus, indicates that an atom or ion has no definite size. Electron density maps compiled in X-ray determinations of crystal structures rarely show zero contours along a metal-anion bond. [Pg.307]

Definition rocking curve (RC) is a function of the total intensity of X-rays reflected by a sample versus its angular position in rotation around the axis perpendicular to the diffraction plane. The sample is adjusted to have diffracting crystallographic planes perpendicular to the diffraction plane. [Pg.257]


See other pages where Angular functions definition is mentioned: [Pg.478]    [Pg.541]    [Pg.155]    [Pg.29]    [Pg.11]    [Pg.77]    [Pg.116]    [Pg.117]    [Pg.18]    [Pg.18]    [Pg.155]    [Pg.659]    [Pg.39]    [Pg.32]    [Pg.110]    [Pg.391]    [Pg.713]    [Pg.198]    [Pg.20]    [Pg.20]    [Pg.83]    [Pg.60]    [Pg.100]    [Pg.101]    [Pg.104]    [Pg.229]    [Pg.96]    [Pg.153]    [Pg.29]    [Pg.82]    [Pg.160]    [Pg.104]    [Pg.229]    [Pg.416]   
See also in sourсe #XX -- [ Pg.257 ]




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