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DFT computational study of trihalogenated aniline derivative’s adsorption onto graphene/fullerene/fullerene-like nanocages, X12Y12 (X = Al, B, and Y = N, P)
(Elsevier, 2022)
Adsorption of 2,4,6-tribromoaniline (BA), 2,4,6-trifluoroaniline (FA) and 2,4,6-trichloroaniline (CA) onto
the surface of coronene/fullerene/fullerene-like nanocages was investigated by theoretical calculations.
Due to ...
Corrosion Science Theoretical and Practical Applications
(CRC Press Taylor Francis, 2022)
Corrosion studies have attracted considerable interest in the areas of materialschemistry and industrial chemistry, as it affects the direct and indirect costs ofindustry, leading to huge economic setbacks due to the need ...
A GENERAL INTRODUCTION TO CORROSION FROM PAST TO PRESENT
(CRC Press, 2022)
A General Introduction to Corrosion from Past to Present
Organic and Inorganic Corrosion Inhibitors
(Wiley, 2022)
Chapter 4
Fluorinated carbon and boron nitride fullerenes for drug Delivery: Computational study of structure and adsorption
(Elsevier, 1 May 2022)
We applied a genetic algorithm combined with the B3LYP/6-311G** approach to determine the structures
of low-energy isomers of partially fluorinated fullerenes, the number of which is combinatorically huge.
We found that ...
Investigation of linear and nonlinear optical absorption coefficients and refractive index changes of a zigzag quantum well with structure parameters and applied external fields
(Elsevier, 2022)
In this study, we have investigated some linear and nonlinear optical properties of GaAs/GaAlAs zigzag quantum well structures under different electric and magnetic field intensities. We also examined the effect of adjustable ...
The nonlinear optical properties of GaAs/GaAlAs triple quantum well: Role of the electromagnetic fields and structural parameters
(ELSEVIER, 2022)
Being relevant to the field of device applications, multiple semiconductor quantum wells are systems that exhibit remarkable optical and electronic properties. These can be properly tuned by suitably modifying the composition, ...
Effects of hydrostatic pressure and temperature on the nonlinear optical properties of GaAs/ GaAlAs zigzag quantum well
(TAYLOR & FRANCIS LTD, 2022)
We have examined theoretically how the temperature and the hydrostatic pressure affect the total optical absorption coefficients, the total refractive index changes, and the second harmonic generation coefficients for ...
On the analysis of stability, bifurcation, and chaos control of discrete-time predator-prey model with Allee effect on predator
(1.04.2022)
In this paper, a discrete predator-prey model with Allee effect which is obtained by the
forward Euler method has been investigated. The local stability conditions of the model
at the fixed point have been discussed. In ...
Effect of immigration in a predator-prey system: Stability, bifurcation and chaos
(AIMS Press, 02/06/2022)
In the present manuscript, a discrete-time predator-prey system with prey immigration is
considered. The existence of the possible fixed points of the system and topological classification of
coexistence fixed point are ...