Moment analysis in collision-induced absorption: Determination of a single parameter empirical model for the induced dipole moment of He-Ar gas mixtures

2021 ◽  
pp. 1-16
Author(s):  
M.S.A. El-Kader ◽  
G. Maroulis
Keyword(s):  
Dipole Moment ◽  
Empirical Model ◽  
Adjustable Parameter ◽  
Classical Physics ◽  
Induced Absorption ◽  
Induced Dipole ◽  
Absorption Determination ◽  
Ar Gas ◽  
Good Agreement

We present a method for the construction of a one-adjustable-parameter empirical model for the induced dipole moment. The method is based on classical physics principles and relies on the first three spectral moments of the collision-induced absorption spectra at various temperatures and new interaction potentials. In this work it is applied to the spectra of He-Ar mixtures. Our values are in good agreement with the available ab initio data. The profiles calculated with these models at various temperatures are in excellent agreement with experiment.

Lineshapes and dipole moments in collision-induced absorption

1981 ◽  
Vol 59 (10) ◽  
pp. 1544-1554 ◽  
Author(s):  
George Birnbaum ◽  
Michael S. Brown ◽  
Lothar Frommhold
Keyword(s):  
Dipole Moment ◽  
Dipole Moments ◽  
Empirical Models ◽  
Fundamental Theory ◽  
Potential Models ◽  
Induced Absorption ◽  
Induced Dipole ◽  
Substantial Error ◽  
Argon Mixture ◽  
Helium Neon

Wave mechanical lineshapes of collision-induced absorption spectra are computed for binary mixtures of argon with helium, neon, and krypton using theoretical dipole moments as input. Comparison with measured spectra shows satisfactory agreement except for the neon–argon mixture, for which either theory or measurement is seen to be in substantial error. Empirical models of the collision-induced dipole moment which reproduce the experimental spectra more closely than the fundamental theory are also given. Best agreement between computed and experimental lineshapes is obtained when potential models which are accurate in the repulsive region are used.

Spectral lineshapes of collision-induced absorption (CIA) using isotropic intermolecular potential for N2-CH4

2021 ◽  
Vol 21 (4) ◽  
pp. 1063-1078
Author(s):  
M.S.A. El-Kader ◽  
G. Maroulis ◽  
T. Bancewicz
Keyword(s):  
Potential Model ◽  
Dipole Moments ◽  
Molecular Nitrogen ◽  
Intermolecular Potential ◽  
Gaseous Mixtures ◽  
Induced Absorption ◽  
Induced Dipole ◽  
Different Temperatures ◽  
Experimental Absorption ◽  
Good Agreement

Quantum mechanical lineshapes of collision-induced absorption (CIA) at different temperatures are computed for gaseous mixtures of molecular nitrogen and methane using theoretical values for the induced dipole moments and intermolecular potential as input. Comparison with theoretical absorption spectra shows satisfactory agreement. An empirical model of the dipole moment which reproduces the experimental spectra and the first three spectral moments more closely than the fundamental theory, is also presented. Good agreement between computed and experimental absorption lineshapes is obtained when a potential model which is constructed from the thermophysical and transport properties is used.

Theory of Intercollisional Interference Effects. IV. Does a Zero Minimum in Induced Absorption Imply the Proportionality of the Induced Dipole Moment to the Force?

1973 ◽  
Vol 51 (23) ◽  
pp. 2455-2458 ◽  
Author(s):  
J. Courtenay Lewis
Keyword(s):  
Dipole Moment ◽  
Lorentz Gas ◽  
Intermolecular Force ◽  
Interference Effects ◽  
Induced Absorption ◽  
Induced Dipole ◽  
Interference Minimum

We show that, within the limits of the theory of intercollisional interference effects developed for collision-induced absorption by a Lorentz gas in paper I of this series, an intercollisional interference minimum which goes precisely to zero implies that the induced dipole moment is exactly proportional to the intermolecular force.

Theoretical Calculation of the Rototranslational Collision-Induced Absorption (CIA) Spectra in O2–O2 Pairs

2016 ◽  
Vol 230 (8) ◽  
Author(s):  
Mohamed S. A. El-Kader
Keyword(s):  
Room Temperature ◽  
Interatomic Potential ◽  
Dipole Moments ◽  
Full Range ◽  
Quantum Mechanical ◽  
Fundamental Theory ◽  
Induced Absorption ◽  
Induced Dipole ◽  
Good Agreement

AbstractQuantum mechanical lineshapes of collision-induced absorption (CIA) at room temperature are computed for gaseous molecular oxygen using theoretical values for induced dipole moments and new isotropic interatomic potential as input. Comparison with measured spectra of the rototranslational collision-induced absorption shows good agreement over the full range of frequencies. Empirical models of the dipole moment which reproduce the experimental spectra and the first two spectral moments more closely than the fundamental theory are also given. The quality of the present potential has been checked by comparing between calculated and experimental thermo-physical and transport properties over a wide temperature range, which are found to be in good agreement.

On the Theory of Collision-Induced Absorption in Rare Gas Mixtures

1971 ◽  
Vol 49 (7) ◽  
pp. 837-847 ◽  
Author(s):  
S. L. Brenner ◽  
D. A. McQuarrie
Keyword(s):  
Absorption Spectrum ◽  
Dipole Moment ◽  
Far Infrared ◽  
Gas Mixtures ◽  
Moment Function ◽  
Rare Gas ◽  
Induced Absorption ◽  
Induced Dipole ◽  
Calculated Equilibrium

The observed far-infrared collision-induced absorption of helium–argon mixtures is used to determine the parameters in an induced-dipole moment function of the form[Formula: see text]It is shown that, with this form of μ(r), the values of the constants μo, ρ, and c7 that are necessary to fit the first two moments of the observed absorption contour are in disagreement with the available theoretical values of these constants. Possible explanations for this disagreement are discussed in the paper. Finally, it is shown that if μ(r) were known, it is possible to obtain an excellent representation of the entire absorption spectrum from a knowledge of only the first three moments, which are easily calculated equilibrium quantities.

COMPARATIVE ACTION OF VARIOUS OESTROGENIC COMPOUNDS ON MOUSE VAGINAL SIALIC ACIDS (II)

1969 ◽  
Vol 62 (4) ◽  
pp. 663-670 ◽  
Author(s):  
Lars Carlborg
Keyword(s):  
Sialic Acid ◽  
Response Curve ◽  
Sialic Acids ◽  
Clear Cut ◽  
Suitable Parameter ◽  
Sufficient Degree ◽  
Comparative Action ◽  
Relative Potencies ◽  
Good Agreement

ABSTRACT Oestrogens administered in lower doses than necessary to induce full cornification of the mouse vagina induce mucification. It was shown previously that the degree of mucification could be estimated by quantitative determination of sialic acids. A suitable parameter for oestrogen assay was the measurement of vaginal sialic acid concentration which exhibited a clear cut dose response curve. Eleven assays of various oestrogens were performed with this method. Their estimated relative potencies were in good agreement with other routine oestrogen assays. A statistically sufficient degree of precision was found. The sensitivity was of the same order, or slightly higher, than the Allen-Doisy test.

Atomic absorption determination of Hg (II), Cd (II), and As (III) in natural and waste water after preliminary group preconcentration

2019 ◽  
Vol 85 (2) ◽  
pp. 12-16
Author(s):  
I. V. Saunina ◽  
E. N. Gribanov ◽  
E. R. Oskotskaya
Keyword(s):  
Waste Water ◽  
Atomic Absorption ◽  
High Sensitivity ◽  
Distribution Coefficients ◽  
Neutral Medium ◽  
Atomic Absorption Determination ◽  
Absorption Determination ◽  
Relative Standard ◽  
Preliminary Group

The sorption of Hg (II), Cd (II), and As (III) by natural aluminosilicate is studied. It is shown that the mineral absorbs those toxicants in a rather wide pH range, quantitative extraction of analytes being achieved in a neutral or close to neutral medium (pH values range within 7.0 - 8.0; 6.3 - 7.5; 7.4 - 8.5 for Hg (II), As (III), and Cd (II), respectively). The effect of the time of phase contact on the degree of extraction of elements is shown. The sorption capacity of the mineral in optimal conditions of the medium acidity (0.06 mmol/g for mercury, 0.31 mmol/g for cadmium, and 0.52 mmol/g for arsenic) is determined. The distribution coefficients attain values of aboutnX 103-nX 104. A new combined method for determination of Hg (II), Cd (II), and As (III) in natural and waste water is developed and tested. The method consists in a preliminary group sorption concentration of the analytes by aluminosilicate, desorption of the analytes from the surface of the mineral and their subsequent atomic absorption determination. The correctness of the method is verified in analysis of spiked samples. The method is easy to use and exhibits high sensitivity, reproducibility and accuracy of analyte determination. The relative standard deviation does not exceed 0.13. Economic availability and possibility of using domestic sorption materials are the important advantages of the proposed procedure which can be used in the practice of laboratories monitoring the quality and safety of environmental objects.

An Automated Method for the Determination of Serum Calcium with Glyoxal Bis (2-Hydroxyanil)

1967 ◽  
Vol 13 (6) ◽  
pp. 515-520 ◽  
Author(s):  
Genevieve Farese ◽  
Janice L Schmidt ◽  
Milton Mager
Keyword(s):  
Serum Calcium ◽  
Automated Analysis ◽  
Automated Method ◽  
Good Agreement

Abstract A completely automated analysis is described for the determination of serum calcium with glyoxal bis (2-hydroxyanil) solution (GBHA). The method is simple and precise, and the data obtained are in good agreement with results obtained by the manual GBHA procedure.

Numerical evaluation of hydrodynamic characteristics of planing hulls by using a hybrid method

2021 ◽  
pp. 147509022199024
Author(s):  
Emre Kahramanoglu ◽  
Silvia Pennino ◽  
Huseyin Yilmaz
Keyword(s):  
Experimental Data ◽  
Hybrid Method ◽  
Design Stage ◽  
Hydrodynamic Characteristics ◽  
Calm Water ◽  
Preliminary Design Stage ◽  
Reduction Function ◽  
Hull Forms ◽  
Good Agreement

The hydrodynamic characteristics of the planing hulls in particular at the planing regime are completely different from the conventional hull forms and the determination of these characteristics is more complicated. In the present study, calm water hydrodynamic characteristics of planing hulls are investigated using a hybrid method. The hybrid method combines the dynamic trim and sinkage from the Zarnick approach with the Savitsky method in order to calculate the total resistance of the planing hull. Since the obtained dynamic trim and sinkage values by using the original Zarnick approach are not in good agreement with experimental data, an improvement is applied to the hybrid method using a reduction function proposed by Garme. The numerical results obtained by the hybrid and improved hybrid method are compared with each other and available experimental data. The results indicate that the improved hybrid method gives better results compared to the hybrid method, especially for the dynamic trim and resistance. Although the results have some discrepancies with experimental data in terms of resistance, trim and sinkage, the improved hybrid method becomes appealing particularly for the preliminary design stage of the planing hulls.

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