Zobrazeno 1 - 6
of 6
pro vyhledávání: '"Abdulhadi Mirdan Ghaleb"'
Publikováno v:
East European Journal of Physics, Iss 1, Pp 197-204 (2023)
A theoretical study on the thymoquinone compound has been performed through two theoretical methods, DFT/B3LYP and HF with 6-31G, 6-31G(d, p) and 6-31++G(d, p) basis sets using Gaussian 09 program. Some theoretical properties, like vibrational and el
Externí odkaz:
https://doaj.org/article/1742c941ca334dac96de977baa622829
Autor:
Sameen F. Mohammed, Salah M.A. Ridha, Abdulhadi Mirdan Ghaleb, Zahraa Talib Ghaleb, Yamina Benkrima, Mahran Abdulrhman Abdullah
Publikováno v:
East European Journal of Physics, Iss 2 (2023)
First-principles computations of the electrical characteristics of AlAs have been carried out using the density functional theory-DFT and the Local Density Approximation-LDA,methods (DFT) and Generalized Gradient Approximation-GGA. We utilized the CA
Externí odkaz:
https://doaj.org/article/28fa1f04964e488e985118f5b4b7c8ab
Autor:
null Abdulhadi Mirdan Ghaleb
Publikováno v:
Tikrit Journal of Pure Science. 21:126-131
In this paper, a theoretical study of calculating Compton profiles(CPs) for β-Zr using the renormalized-free-atom model and free electron model for different configurations (4d3-x-5s1+x),where (x= 0.1 to 1 step 0.1) is presented .The theoretical res
Publikováno v:
International Journal of Nanoscience. 20:2150018
This work investigates the electronic momentum density (EMD) distribution in nanosize zirconia (ZrO2) using the technique of Compton scattering. The ZrO2 nanoparticles (11.2[Formula: see text]nm) are synthesized of mechanical milling and characterize
Autor:
Kailash Chandra Bhamu, B. L. Ahuja, Sahariya Jagrati, Fareed Majeed Mohammad, Abdulhadi Mirdan Ghaleb
Publikováno v:
Natural Science. :797-802
In the present paper, first ever experimental Compton profile of Nd2O3 have been measured using 137Cs Compton spectrometer at an intermediate resolution of 0.34 a.u. Theoretical profile are computed using PP-DFT-GGA, PP-DFT- LDA and PP-DFT-SOGGA with
Publikováno v:
Baghdad Science Journal. 13:0167
In this paper we present the first ever measured experimental electron momentum density of Cu2Sb at an intermediate resolution (0.6 a.u.) using 59.54 keV 241Am Compton spectrometer. The measurements are compared with the theoretical Compton profiles