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Excitation indices

The two-electron integrals involve the LCAO orbitals, and the time-consuming part of a traditional Cl calculation is the transformation of these to integrals involving the basis functions. This is often referred to as the four-index transformation. Not only that, it turns out that traditional Cl calculations are very slowly convergent we have to add a vast number of excited states in order to improve the energy significantly. [Pg.189]

Being applied for the relaxation of populations (k = 0), this equality expresses the demands of the detailed balance principle. This is simply a generalization of Eq. (4.25), which establishes the well-known relation between rates of excitation and deactivation for the rotational spectrum. It is much more important that equality (5.21) holds not only for k = 0 but also for k = 1 when it deals with relaxation of angular momentum J and the elements should not be attributed any obvious physical sense. The non-triviality of this generalization is emphasized by the fact that it is impossible to extend it to the elements of the four-index... [Pg.161]

In addition, combining the microscope with the use of a pulsed laser light source provides temporal information on these systems in a small domain. The dispersion of refractive index, however, strongly affects the temporal resolution in the measurements of dynamics under the microscope and typical resolution stays around 100 fs when a Ti Sapphire laser is used as an excitation source. [Pg.134]

Figure 9.2 Normalized transmittance measured by the Z-scan with and without the collecting aperture for CdTe QDs with the diameter of 4.1 nm excited at 803 nm (0.4 pj pulse ). The open aperture Z-scan corresponds to the nonlinear absorption and the closed aperture Z-scan to the nonlinear refractive index. Figure 9.2 Normalized transmittance measured by the Z-scan with and without the collecting aperture for CdTe QDs with the diameter of 4.1 nm excited at 803 nm (0.4 pj pulse ). The open aperture Z-scan corresponds to the nonlinear absorption and the closed aperture Z-scan to the nonlinear refractive index.
In this Section we want to present one of the fingerprints of noble-metal cluster formation, that is the development of a well-defined absorption band in the visible or near UV spectrum which is called the surface plasma resonance (SPR) absorption. SPR is typical of s-type metals like noble and alkali metals and it is due to a collective excitation of the delocalized conduction electrons confined within the cluster volume [15]. The theory developed by G. Mie in 1908 [22], for spherical non-interacting nanoparticles of radius R embedded in a non-absorbing medium with dielectric constant s i (i.e. with a refractive index n = Sm ) gives the extinction cross-section a(o),R) in the dipolar approximation as ... [Pg.275]

FIG. 44. Plasma parameters as deduced from the lEDs and material properties as a function of power delivered to the SiHa-Ar discharge at an excitation frequency of 50 MHz and a pressure of 0.4 mbar (a) the plasma potential Vp (circles) and dc self bias (triangles), (b) the sheath thickness d, (c) the maximum ion flux r ax. (d) the growth rate r,/. (e) the microstructure parameter R. and (f) the refractive index ni ev- (Compiled from E. A. G. Hamers. Ph.D. Thesis, Universiteit Utrecht, Utrecht, the Netherlands. 1998.)... [Pg.120]

Solvents with different polarities and refractive indexes significantly affect carotenoid optical properties. Because the refractive index is proportional to the ability of a solvent molecule to interact with the electric held of the solute, it can dramatically affect the excited state energy and hence the absorption maxima positions (Bayliss, 1950). Figure 7.2a shows three absorption spectra of the same xanthophyll, lutein, dissolved in isopropanol, pyridine, and carbon disulfide. The solvent refractive indexes in this case were 1.38, 1.42, and 1.63 for the three mentioned solvents, respectively. [Pg.116]

If measurements are made in thin oxide films (of thickness less than 5 nm), at highly polished Al, within a small acceptance angle (a < 5°), well-defined additional maxima and minima in excitation (PL) and emission (PL and EL) spectra appear.322 This structure has been explained as a result of interference between monochromatic electromagnetic waves passing directly through the oxide film and EM waves reflected from the Al surface. In a series of papers,318-320 this effect has been explored as a means for precise determination of anodic oxide film thickness (or growth rate), refractive index, porosity, mean range of electron avalanches, transport numbers, etc. [Pg.487]

TGA, iodometric, mid-IR, luminescence (fluorescence and phosphorescence) and colour formation (yellowness index according to standard method ASTM 1925) were all employed in a study of aspects of the thermal degradation of EVA copolymers [67], Figure 23 compares a set of spectra from the luminescence analysis reported in this work. In the initial spectra (Figure 23(a)) of the EVA copolymer, two excitation maxima at 237 and 283 nm are observed, which both give rise to one emission spectrum with a maximum at 366 nm weak shoulders... [Pg.419]

The fluorescent components are denoted by I (intensity) followed by a capitalized subscript (D, A or s, for respectively Donors, Acceptors, or Donor/ Acceptor FRET pairs) to indicate the particular population of molecules responsible for emission of/and a lower-case superscript (d or, s) that indicates the detection channel (or filter cube). For example, / denotes the intensity of the donors as detected in the donor channel and reads as Intensity of donors in the donor channel, etc. Similarly, properties of molecules (number of molecules, N quantum yield, Q) are specified with capitalized subscript and properties of channels (laser intensity, gain, g) are specified with lowercase superscript. Factors that depend on both molecular species and on detection channel (excitation efficiency, s fraction of the emission spectrum detected in a channel, F) are indexed with both. Note that for all factorized symbols it is assumed that we work in the linear (excitation-fluorescence) regime with negligible donor or acceptor saturation or triplet states. In case such conditions are not met, the FRET estimation will not be correct. See Chap. 12 (FRET calculator) for more details. [Pg.346]

Fig. 1. Oxygen abundances as a function of the activity index, Rx, derived from X-ray data (left-hand panels) and the excitation temperature Texc (right-hand panels). The bottom panels show the difference between [O/Fe] yielded by the OI triplet at about 7774 A and the [OI] A6300 line. Filled circles RS CVn binaries ([2] and [3]), filled squares field subgiants [3], filled triangles Pleiades stars, open triangles Hyades stars, open circles, squares and hexagons disk dwarfs. The source of the literature data for the open cluster and Galactic disk stars can be found in [4]. Fig. 1. Oxygen abundances as a function of the activity index, Rx, derived from X-ray data (left-hand panels) and the excitation temperature Texc (right-hand panels). The bottom panels show the difference between [O/Fe] yielded by the OI triplet at about 7774 A and the [OI] A6300 line. Filled circles RS CVn binaries ([2] and [3]), filled squares field subgiants [3], filled triangles Pleiades stars, open triangles Hyades stars, open circles, squares and hexagons disk dwarfs. The source of the literature data for the open cluster and Galactic disk stars can be found in [4].

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See also in sourсe #XX -- [ Pg.50 ]




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