Zobrazeno 1 - 10
of 33
pro vyhledávání: '"Ali H"'
Autor:
Ali H. Reshak, Ghulam Murtaza, Mohammad Sohail, Abdullah Abdullah, Aurangzeb Khan, Zaffar Iqbal, Syed Zulfiqar, Nasir Rahman, Saima Naz Khan, Rajwali Khan, Mudasser Husain, Muhammad Umer
Publikováno v:
The European Physical Journal Plus. 136
In this paper, we report some physical properties of Half-Heusler ScVX (X = Si, Ge, Sn, and Pb) compounds using the first-principle investigations employing density functional theory (DFT) within the WIEN2k. Simulations are carried out using the gene
Autor:
M. Jamal, Ali H. Reshak
Publikováno v:
Journal of Physics and Chemistry of Solids. 116:131-136
A new package called 2DRoptimize has been released for performing two-dimensional searches of the equation of state (EOS) for rhombohedral, tetragonal, and hexagonal compounds. The package is compatible and available with the WIEN2k package. The 2DRo
Highly desirable semiconducting materials for mid-IR optoelectronics: Dilute bismide InAs1−Bi alloys
Publikováno v:
Materials Research Bulletin. 95:588-596
We have performed a self-consistent full-potential linearized augmented plane wave (FP-LAPW) method within density functional theory (DFT) to investigate the structural, electronic and optical properties of the dilute bismide InAs 1− x Bi x alloys
Publikováno v:
Journal of Alloys and Compounds. 689:885-893
We report on a comprehensive theoretical investigation of the physical properties of the cubic MgCu2-type binary Laves phases TbCo2 and TbFe2 compounds. The density functional full-potential linearized augmented planewave (FP-LAPW) method was used. W
Publikováno v:
Journal of Electronic Materials. 46:130-142
We report on the investigation of the structural and physical properties of the Co2VZ (Z = Al, Ga) Heusler alloys, with L21 structure, through first-principles calculations involving the full potential linearized augmented plane-wave method within de
Autor:
J. Chyský, Zeyad A. Alahmed, Hussin Kamarudin, Roshan Ali, Ali H. Reshak, Haleem Ud Din, J. Bila, Ghulam Murtaza, Bin Amin
Publikováno v:
Indian Journal of Physics
First principle calculations of structural, elastic, thermal and electronic properties of M2X (M = Sr, Ba and X = Si, Ge, Sn) compounds in the anti-fluorite type structure are performed within the framework of density functional theory. The lattice c
Autor:
Ali H. Reshak, F. Litimein, A. Bouhemadou, S. Bin Omran, Ghulam Murtaza, Rabah Khenata, Masood Yousaf, Prafulla K. Jha, Sanjeev K. Gupta
Publikováno v:
Journal of Materials Science. 49:7809-7818
We performed ab initio calculations using the FPLAW method with the local density approximation (LDA) implemented in the WIEN2 k code for the orthorhombic (α) and triclinic (β) phases of BiNbO4. The modified Becke–Johnson exchange potential (mBJ)
Publikováno v:
Computational Materials Science. 87:172-177
The electronic and magnetic properties of the ferromagnetic laves-phase GdX 2 (X = Fe, Co and Ni) intermetallic compounds were calculated by using an all-electron full-potential linear muffin–tin orbital method (FP-LMTO) within GGA and GGA + U. The
Autor:
Ali H. Reshak, Haleem Ud Din
Publikováno v:
Computational Materials Science. 83:474-480
In present paper, the structural, elastic, thermal, electronic, optical properties at ambient and high-pressure study of Ag 2 O are performed using the full-potential linearized augmented plane wave (FP-LAPW) method within the framework of Density fu
Autor:
Ali H. Reshak, S. Bin Omran, M. Rabah, Djamel Rached, S. Benalia, Rabah Khenata, Habib Rached
Publikováno v:
Materials Chemistry and Physics. 143:93-108
The structural stabilities, elastic and electronic properties of 5d transition metal mononitrides (TMNs) XN with (X = Ir, Os, Re, W and Ta) and 5d transition metal monocarbides (TMCs) XC with (X = Ir, Os, Re and Ta) were investigated using the full-p