scholarly journals Co(II) Optical Absorption in Spinels: Infrared and Ligand-Field Spectroscopic Study of the Ionicity of the bond. Magnetic Structure and Co2+→Fe3+MMCT in Ferrites. Correlation with the Magneto-Optical Properties

1998 ◽  
Vol 20 (3) ◽  
pp. 169-187 ◽  
Author(s):  
F. Hochu ◽  
M. Lenglet
Keyword(s):  
Optical Properties ◽  
Optical Absorption ◽  
Spectroscopic Study ◽  
Cation Distribution ◽  
Linear Relation ◽  
Optical Spectrum ◽  
Ligand Field ◽  
Racah Parameter ◽  
Cobalt Ferrites ◽  
Ligand Field Spectra

The analysis of the infrared and ligand field spectra of COM2O4spinels reveals that the ionicity of these compounds varies in the following order aluminate > gallate > ferrite and chromite > rhodite and cobaltite. A linear relation has been established between the Δ(LO-TO)1splitting, Racah parameter and the ionic-covalent parameterSSp=ΣICP+tetra∑ICPocta. The influence of strong superexchange interactions on the optical spectrum of cobalt ferrites has been studied. The cation distribution has been established by EXAFS and XANES measurements. The cluster (CoFeO10)15–is characterized by a large MMCT transition Co2+→Fe3+at 1.65–1.7 eV (FWMH: 1.35–1.95 eV). The4A2→4T1(P) tetrahedral cobalt(II) in ferrimagnetic compounds is overlapped by the MMCT band. This study and the reinvestigation of the iron(III) electronic spectrum is ferrites may explain the magneto-optical properties of mixed cobalt-ferrites.

Impact of Cr3+ substitution on the nephelauxetic ratio and Racah parameter of Cr-Mn-Zn nanoferrites

2021 ◽  
Author(s):  
M. Abdo ◽  
M.S. Sadeq
Keyword(s):  
Optical Absorption ◽  
Absorption Spectra ◽  
Tunable Laser ◽  
Ligand Field ◽  
Optical Absorption Spectra ◽  
B Values ◽  
Racah Parameter ◽  
Low Field ◽  
Optical Applications ◽  
First Time

Abstract For the first time, we present the ligand field splitting (10Dq) nephelauxetic ratio (β), Racah parameter (B) and stability of Cr3+ within Mn–Zn nanoferrite which synthesized using the citrate route. These parameters were determined via optical absorption spectra. The obtained bands in the significance range of optical absorption spectra are wide as well as asymmetric; therefore the deconvolution process becomes a necessary task. The values of 10Dq and B have been estimated from the produced bands. The values of 10Dq are observed to increase from 16366.61 to 16447.37 cm-1 whereas, B values are observed to decrease from 829.81 to 760.80 cm-1 with additional Cr3+ substitution. The increasing 10Dq and decreasing B values, evidence for bonds between Cr3+ ions with their environments became a further covalent (less ionic). Moreover, the values of β are observed to decrease for further Cr3+ substitution. This decrease of β produces less stability between Cr3+ and its ligand. Furthermore, Dq/B values declare that Cr3+ centers are in the low-field sites by a slight tendency towards the high-field sites with further Cr/Fe substitution process. Therefore, it was suggested that Cr3+ substituted Mn–Zn nanoferrites are excellent candidates for diverse optical applications such as a tunable laser.

The Coordination Chemistry of Phosphoryl Compounds Containing the — N(CH3)2 Group, Part VIII

1972 ◽  
Vol 27 (7) ◽  
pp. 759-763 ◽  
Author(s):  
M. W. G. De Bolster ◽  
W. L. Groeneveld
Keyword(s):  
Coordination Chemistry ◽  
General Formula ◽  
Ligand Field ◽  
Chemical Analyses ◽  
X Ray ◽  
Physical Measurements ◽  
Ligand Field Spectra ◽  
Chloride Adduct ◽  
Ligand Field Parameters ◽  
Group Part

A number of new solvates and adducts containing bisphenyldimethylaminophosphine oxide is reported. The solvates have the general formula M[(C6H5)2P(O)N(CH3)2]42+(anion-)2, in which M = Mg, Ca, Mn, Fe, Co, Ni, Cu, Zn and Cd, and the anions are ClO4- and BF4-. The adducts have the general formula M[(C6H5)2P(O)N(CH3)2]2Cl2, where M stands for the same series of metals.The compounds are characterized and identified by chemical analyses and physical measurements.Ligand-field and vibrational spectra have been investigated; values for the ligand-field parameters are reported. It is concluded that coordination takes place via the oxygen atom of the ligand.X-ray powder patterns were used in combination with ligand-field spectra to deduce the coordination around the metal ions.The interesting behaviour of the nickel (II) chloride adduct upon heating is discussed and it is shown that both a square pyramidal and a tetrahedral modification exists.

Optical Properties of Sputtered Silver Granular Films

2005 ◽  
Vol 480-481 ◽  
pp. 287-292 ◽  
Author(s):  
S.E. Paje ◽  
F. Teran ◽  
J.M. Riveiro ◽  
J. Llopis ◽  
M.A. García ◽  
...  
Keyword(s):  
Silver Nanoparticles ◽  
Optical Properties ◽  
Optical Absorption ◽  
Surface Morphology ◽  
Silver Clusters ◽  
Plasmon Excitation ◽  
Granular Films ◽  
Silver Films ◽  
Atomic Force ◽  
Atomic Force Micrographs

In this research we study optical absorption and morphology of silver films prepared with a sputtering method. Silver granular films are obtained on a glass substrate for films with thickness smaller than about 60 Å. Superficial silver clusters of around 100 nm in diameter are clearly seen in the atomic force micrographs. The absorption of these samples are characterized by plasmon excitation in the 450-650 nm spectral range, which differs from the known excitation of silver nanoparticles fabricated by different techniques. The optical absorption of silver granular films depend on sputtering conditions like substrate temperature or deposition rate and correlates with the surface morphology.

scholarly journals Tuning the optoelectronic properties of hematite with rhodium doping for photoelectrochemical water splitting using density functional theory approach

2021 ◽  
Vol 11 (1) ◽  
Author(s):  
Abdur Rauf ◽  
Muhammad Adil ◽  
Shabeer Ahmad Mian ◽  
Gul Rahman ◽  
Ejaz Ahmed ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Optical Properties ◽  
Optical Absorption ◽  
Water Splitting ◽  
Density Functional ◽  
Formation Energy ◽  
Visible Region ◽  
Photoelectrochemical Water Splitting ◽  
Theory Approach ◽  
Functional Theory

AbstractHematite (Fe2O3) is one of the best candidates for photoelectrochemical water splitting due to its abundance and suitable bandgap. However, its efficiency is mostly impeded due to the intrinsically low conductivity and poor light absorption. In this study, we targeted this intrinsic behavior to investigate the thermodynamic stability, photoconductivity and optical properties of rhodium doped hematite using density functional theory. The calculated formation energy of pristine and rhodium doped hematite was − 4.47 eV and − 5.34 eV respectively, suggesting that the doped material is thermodynamically more stable. The DFT results established that the bandgap of doped hematite narrowed down to the lower edge (1.61 eV) in the visible region which enhanced the optical absorption and photoconductivity of the material. Moreover, doped hematite has the ability to absorb a broad spectrum (250–800) nm. The enhanced optical absorption boosted the photocurrent and incident photon to current efficiency. The calculated results also showed that the incorporation of rhodium in hematite induced a redshift in optical properties.

scholarly journals Comparative Study on Electronic Structure and Optical Properties of α-Fe2O3, Ag/α-Fe2O3 and S/α-Fe2O3

Metals ◽  
2021 ◽  
Vol 11 (3) ◽  
pp. 424
Author(s):  
Cuihua Zhao ◽  
Baishi Li ◽  
Xi Zhou ◽  
Jianhua Chen ◽  
Hongqun Tang
Keyword(s):  
Optical Properties ◽  
Optical Absorption ◽  
Electronic Structures ◽  
Density Functional ◽  
Peak Strength ◽  
Visible Range ◽  
High Symmetry ◽  
Functional Theory ◽  
Optical Absorption Peak ◽  
Calculation Results

The electronic structures and optical properties of pure, Ag-doped and S-doped α-Fe2O3 were studied using density functional theory (DFT). The calculation results show that the structure of α-Fe2O3 crystal changes after Ag and S doping, which leads to the different points of the high symmetry of Ag-doped and S-doped α-Fe2O3 with that of pure α-Fe2O3 in the energy band, as well as different Brillouin paths. In addition, the band gap of α-Fe2O3 becomes smaller after Ag and S doping, and the optical absorption peak shifts slightly toward the short wavelength, with the increased peak strength of S/α-Fe2O3 and the decreased peak strength of Ag/α-Fe2O3. However, the optical absorption in the visible range is enhanced after Ag and S doping compared with that of pure α-Fe2O3 when the wavelength is greater than 380 nm, and the optical absorption of S-doped α-Fe2O3 is stronger than that of Ag-doped α-Fe2O3.

scholarly journals Numerical Simulation on Spatial-Frequency Domain Imaging for Estimating Optical Absorption and Scattering Properties of Two-Layered Horticultural Products

2021 ◽  
Vol 11 (2) ◽  
pp. 617
Author(s):  
Dong Hu ◽  
Yuping Huang ◽  
Qiang Zhang ◽  
Lijian Yao ◽  
Zidong Yang ◽  
...  
Keyword(s):  
Optical Properties ◽  
Optical Property ◽  
Optical Absorption ◽  
Spatial Frequency ◽  
Estimation Accuracy ◽  
Property Estimation ◽  
Spatial Frequencies ◽  
Stepwise Method ◽  
Horticultural Products ◽  
Layered Samples

Spatial-frequency domain imaging (SFDI) is a wide-field, noncontact, and label-free imaging modality that is currently being explored as a new means for estimating optical absorption and scattering properties of two-layered turbid materials. The accuracy of SFDI for optical property estimation, however, depends on light transfer model and inverse algorithm. This study was therefore aimed at providing theoretical analyses of the diffusion model and inverse algorithm through numerical simulation, so as to evaluate the potential for estimating optical absorption and reduced scattering coefficients of two-layered horticultural products. The effect of varying optical properties on reflectance prediction was first simulated, which indicated that there is good separation in diffuse reflectance over a large range of spatial frequencies for different reduced scattering values in the top layer, whereas there is less separation in diffuse reflectance for different values of absorption in the top layer, and even less separation for optical properties in the bottom layer. To implement the nonlinear least-square method for extracting the optical properties of two-layered samples from Monte Carlo-generated reflectance, five curve fitting strategies with different constrained parameters were conducted and compared. The results confirmed that estimation accuracy improved as fewer variables were to be estimated each time. A stepwise method was thus suggested for estimating optical properties of two-layered samples. Four factors influencing optical property estimation of the top layer, which is the basis for accurately implementing the stepwise method, were investigated by generating absolute error contour maps. Finally, the relationship between light penetration depth and spatial frequency was studied. The results showed that penetration depth decreased with the increased spatial frequency and also optical properties, suggesting that appropriate selection of spatial frequencies for a stepwise method to estimate optical properties from two-layered samples provides potential for estimation accuracy improvement. This work lays a foundation for improving optical property estimation of two-layered horticultural products using SFDI.

LINEAR AND NONLINEAR INTERSUBBAND OPTICAL ABSORPTION OF FINITE AND INFINITE SEMI-PARABOLIC QUANTUM WELLS

2011 ◽  
Vol 25 (07) ◽  
pp. 497-507 ◽  
Author(s):  
M. J. KARIMI ◽  
A. KESHAVARZ ◽  
A. POOSTFORUSH
Keyword(s):  
Refractive Index ◽  
Optical Properties ◽  
Optical Absorption ◽  
Quantum Well ◽  
Quantum Wells ◽  
Resonant Peak ◽  
Energy Eigenvalues ◽  
Finite Case ◽  
Infinite Case ◽  
Index Changes

In this work, the optical absorption coefficients and the refractive index changes for the infinite and finite semi-parabolic quantum well are calculated. Numerical calculations are performed for typical GaAs / Al x Ga 1-x As semi-parabolic quantum well. The energy eigenvalues and eigenfunctions of these systems are calculated numerically. Optical properties are obtained using the compact density matrix approach. Results show that the energy eigenvalues and the matrix elements of the infinite and finite cases are different. The calculations reveal that the resonant peaks of the optical properties of the finite case occur at lower values of the incident photon energy with respect to the infinite case. Results indicate that the maximum value of the refractive index changes for the finite case are greater than that of the infinite case. Our calculations also show that in contrast to the infinite case, the resonant peak value of the total absorption coefficient in the case of the finite well is a non-monotonic function of the semi-parabolic confinement frequency.

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