A Comparison of Different Computer-Oriented Methods for the Energy Bands of Solids

1971 ◽  
pp. 3-15
Author(s):  
John W. D. Connolly
Keyword(s):  
Energy Bands

Preparation, Electronic Structure and Optical Properties of the Electrochromic Thin Films

2004 ◽  
Vol 9 (4) ◽  
pp. 363-372 ◽  
Author(s):  
T. Lukaszewicz ◽  
A. Ravinski ◽  
I. Makoed
Keyword(s):  
Electrochromic Device ◽  
Orbital Method ◽  
Optical Parameters ◽  
Full Potential ◽  
Electrochromic Devices ◽  
Energy Bands ◽  
Conducting Film ◽  
Recombination Probability ◽  
Transparent Conducting ◽  
Smoluchowski Equations

A new multilayer electrochromic device has been constructed according to the following pattern: glass1/ITO/WO3/gel electrolyte/BP/ITO/glass2, where ITO is a transparent conducting film made of indium and tin oxide and with the surface resistance equal 8–10 Ω/cm2 . The electrochromic devices obtained in the research are characterized by great (considerable) transmittance variation between coloration and bleaching state (25–40% at applied voltage of 1.5 to 3 V), and also high coloration efficiency (above 100 cm2 /C). Selfconsistent energy bands, dielectric permittivity and optical parameters are calculated using a full-potential linear muffin-tin orbital method. The numerical solution of the Debye-Smoluchowski equations is developed for simulating recombination probability of Li+ ions in amorphous electrolyte.

Acoustical Properties of Speech as Indicators of Depression and Suicidal Risk

2008 ◽  
Vol 4 ◽  
Author(s):  
Michael Joshua Landau
Keyword(s):  
Multiple Regression ◽  
Energy Band ◽  
Mental States ◽  
Cross Product ◽  
Female Group ◽  
Suicidal Risk ◽  
Energy Bands ◽  
Band Ratio ◽  
Acoustical Properties ◽  
Male Group

Acoustical properties of speech have been shown to be related to mental states such as remission and depression. The objective of this project was to relate the energy in frequency bands with the severity of the mental state using the Beck Depression Inventory (BDI). Recorded speech was obtained from male and female subjects with mental states of remission, depression, and suicidal risk. These subjects had recorded automated and spontaneous speech samples. Multiple regression analysis was used to relate the independent energy band ratio variables with the dependent BDI scores, and thus allow the determination of equitable BDI scores for future patients. For the male group, the square of the 3rd energy band and the cross-product of the 2nd and 3rd energy band were prominent in both the reading and interviewed groups. Therefore the equation with the 2nd lowest Akaike Information Criterion (AIC) score was chosen for the reading male group, and the 1st lowest AIC score was chosen for the interviewed male group. For the female group, the square and cross-product of the 1st and 2nd energy bands were prominent in both the reading and interviewed groups. Therefore the 2nd lowest AIC score was chosen for the reading female group, and the 1st lowest AIC score was chosen for the interviewed female group. The clinician could thus determine the patient’s mood or state of mind by comparing the estimated BDI score with the ranges of total BDI scores: remitted 0 – 20, depressed 15 – 38, suicidal 38 – 46. Keywords: speech, mental states, power spectra, multiple regression, information theoretic criterion

scholarly journals Effect of Laser Irradiation on Emissivity of Flame-Generated Nanooxides

Materials ◽  
2021 ◽  
Vol 14 (9) ◽  
pp. 2303
Author(s):  
Silvana De Iuliis ◽  
Roberto Dondè ◽  
Igor Altman
Keyword(s):  
Laser Irradiation ◽  
Light Emission ◽  
Energy Gap ◽  
Particle Temperature ◽  
Electron Excitation ◽  
Flame Spray ◽  
Energy Bands ◽  
Light Emitting ◽  
Spectral Behavior ◽  
The Difference

The application of pyrometry to retrieve particle temperature in particulate-generating flames strictly requires the knowledge of the spectral behavior of emissivity of light-emitting particles. Normally, this spectral behavior is considered time-independent. The current paper challenges this assumption and explains why the emissivity of oxide nanoparticles formed in flame can change with time. The suggested phenomenon is related to transitions of electrons between the valence and conduction energy bands in oxides that are wide-gap dielectrics. The emissivity change is particularly crucial for the interpretation of fast processes occurring during laser-induced experiments. In the present work, we compare the response of titania particles produced by a flame spray to the laser irradiation at two different excitation wavelengths. The difference in the temporal behavior of the corresponding light emission intensities is attributed to the different mechanisms of electron excitation during the laser pulse. Interband transitions that are possible only in the case of the laser photon energy exceeding the titania energy gap led to the increase of the electron density in the conduction band. Relaxation of those electrons back to the valence band is the origin of the observed emissivity drop after the UV laser irradiation.

scholarly journals Role of substrate strain to tune energy bands–Seebeck relationship in semiconductor heterostructures

2021 ◽  
Vol 129 (2) ◽  
pp. 025301
Author(s):  
Vitaly S. Proshchenko ◽  
Manoj Settipalli ◽  
Artem K. Pimachev ◽  
Sanghamitra Neogi
Keyword(s):  
Semiconductor Heterostructures ◽  
Energy Bands ◽  
Substrate Strain

scholarly journals X-Ray Emission Differences in SNR MSH14-63

1998 ◽  
Vol 11 (1) ◽  
pp. 393-393
Author(s):  
Fangjun Lu ◽  
Mei Wu ◽  
Tipei Li ◽  
Xuejun Sun
Keyword(s):  
Large Scale ◽  
Physical Characteristics ◽  
Energy Bands ◽  
X Ray

In the paper we report the discovery of X-ray emission differences in SNR MSH14-63 based on the ROSAT PSPC observation. The structures of MSH14-63 are different in different energy bands. These images along with the radial brightness distributions in these energy bands show the existence of a region which only emit X-ray photons harder than l.OkeV. Though weak, there actually exist large scale X-ray emissions beyond the bright rim in many parts of the northeast remnant component, which is in conflict with the Sedov phase assumption used in previous research. These new soft X-ray features provide astronomers more information to study its physical characteristics.

The Varied Causes of Color in Glass

1985 ◽  
Vol 61 ◽  
Author(s):  
K. Nassau
Keyword(s):  
Chalcogenide Glasses ◽  
Water Ligand ◽  
Ligand Field ◽  
Energy Bands ◽  
Metal Compounds ◽  
Chemical Mechanisms ◽  
Doped Glasses ◽  
Blue Eyes ◽  
Physical And Chemical ◽  
Ice Water

ABSTRACTAll but two of the fifteen physical and chemical mechanisms which are necessary to explain all the varied causes of color apply in one way or another to glass. These fifteen causes of color derive from a variety of physical and chemical mechanisms and are summarized in five groups with concentration on those mechanisms that apply to glass and the related glazes and enamels. Vibrations and simple excitations explain the colors of incandescence (e.g. flames, hot glass), gas excitations (neon tube, aurora), and vibrations and rotations (blue ice, water, glasses based on water). Ligand field effect colors are seen in transition metal compounds (turquoise, chrome oxide green, glasses based on copper sulfate) and impurities (ruby, emerald, many doped glasses). Molecular orbitals explain the colors of organic compounds (indigo, chlorophyll, organic glasses) and charge transfer compounds (blue sapphire, lapis lazuli, “beer-bottle” brown and chromate glasses). Energy bands are involved in the colors of metals and alloys (gold, brass, glassy metals), of semiconductors (cadmium yellow, vermillion, chalcogenide glasses), doped semiconductors (blue and yellow diamond), and color centers (amethyst, topaz, irradiated glass). Geometrical and physical optics are involved in the colors derived from dispersive refraction (rainbow, green flash, glass prism spectrum), scattering (blue sky, blue eyes, red sunset, ruby gold and opal glasses), interference (soap bubbles, iridescent beetles, cracks in glasses, interference filters), and diffraction (the corona aureole, diffraction grating spectrum).

scholarly journals The effect of pressure and alloying on half-metallicity of quaternary Heusler compounds CoMnYZ (Z = Al, Ga, and In)

2016 ◽  
Vol 34 (4) ◽  
pp. 905-915 ◽  
Author(s):  
M. Rahmoune ◽  
A. Chahed ◽  
A. Amar ◽  
H. Rozale ◽  
A. Lakdja ◽  
...  
Keyword(s):  
Magnetic Properties ◽  
Density Functional ◽  
Heusler Alloys ◽  
Band Gaps ◽  
Ferromagnetic Behavior ◽  
Full Potential ◽  
Energy Bands ◽  
Half Metallicity ◽  
Half Metallic ◽  
Electronic And Magnetic Properties

AbstractIn this work, first-principles calculations of the structural, electronic and magnetic properties of Heusler alloys CoMnYAl, CoMnYGa and CoMnYIn are presented. The full potential linearized augmented plane waves (FP-LAPW) method based on the density functional theory (DFT) has been applied. The structural results showed that CoMnYZ (Z = Al, Ga, In) compounds in the stable structure of type 1+FM were true half-metallic (HM) ferromagnets. The minority (half-metallic) band gaps were found to be 0.51 (0.158), 0.59 (0.294), and 0.54 (0.195) eV for Z = Al, Ga, and In, respectively. The characteristics of energy bands and origin of minority band gaps were also studied. In addition, the effect of volumetric and tetragonal strain on HM character was studied. We also investigated the structural, electronic and magnetic properties of the doped Heusler alloys CoMnYGa1−xAlx, CoMnYAl1−xInx and CoMnYGa1−xInx (x = 0, 0.25, 0.5, 0.75, 1). The composition dependence of the lattice parameters obeys Vegard’s law. All alloy compositions exhibit HM ferromagnetic behavior with a high Curie temperature (TC).

Synergistic effects of nonmetal co-doping with sulfur in anatase TiO2: a DFT + U study

2015 ◽  
Vol 17 (5) ◽  
pp. 3426-3434 ◽  
Author(s):  
Qing-Lu Liu ◽  
Zong-Yan Zhao ◽  
Qing-Ju Liu
Keyword(s):  
Electric Field ◽  
Synergistic Effects ◽  
Anatase Tio2 ◽  
Local Electric Field ◽  
Energy Bands ◽  
Deep Impurity ◽  
Co Doping

S + NM co-doping could induce a stronger local electric field and eliminate the deep impurity energy bands of S mono-doped TiO2.

Overlapping energy bands and the theory of collective electron ferromagnetism

1953 ◽  
Vol 49 (1) ◽  
pp. 115-129 ◽  
Author(s):  
A. B. Lidiard
Keyword(s):  
Curie Point ◽  
Energy Band ◽  
Spontaneous Magnetization ◽  
Copper Alloys ◽  
Implicit Assumption ◽  
Energy Bands ◽  
Unknown Parameters ◽  
Nickel Copper ◽  
Predicted Values ◽  
A Minor

ABSTRACTThe theory of collective electron ferromagnetism given by Stoner applies to a system of electrons in a single energy band; for iron, cobalt and nickel this is identified with the band of states derived from atomic 3d functions. To bring in the generally assumed overlapping of the 3d band by the wide 4s band in these metals, the theory has been extended to take account of the transfer of electrons from 3d to 4s states with change of temperature. A previous calculation of this transfer effect must be regarded as inadequate, for the part played by the exchange energy in determining the distribution of electrons between the two sets of states was omitted. The general equations are derived in § 2 and used as a basis for discussion of the properties of nickel-copper alloys at absolute zero in § 3. In §§4 and 5 numerical results are presented which show the effect of the overlapping 4s band on the magnetic properties of a system such as nickel both above and below its Curie point. Comparison with the measured paramagnetic susceptibility of pure nickel above the Curie point strongly suggests that for this metal the overlapping 4s band has only a minor influence, although in principle the effect could be very large (cf. Fig. 4). This result is not unambiguous, however, because values thus inferred for the two unknown parameters lead to inaccurate predictions below the Curie point. First, the predicted values for the spontaneous magnetization are too small. Secondly, the theory demands that the nickel-copper alloys should only be ferromagnetic below a copper content of about 20 %, whereas experimentally the limit is known to be about 60 %. In conclusion, it is suggested that the implicit assumption of Stoner's theory that the exchange integrals between all pairs of 3d states are equal to one another is a more serious restriction on the theory than the consideration of only a single energy band.

scholarly journals Energy Bands in Paramagnetic Chromium

1973 ◽  
Vol 8 (12) ◽  
pp. 5398-5403 ◽  
Author(s):  
J. Rath ◽  
J. Callaway
Keyword(s):  
Energy Bands
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