scholarly journals Retraction of: Hamada Khelifa, Djaafri Tayeb - Ferromagnetic half-metal for spintronic applications: Ab-initio calculation. - Annals of West University of Timisoara, Vol. 63, 2020, No. 1, pp. 14-25 (DOI: 10.2478/awutp-2021-0002).

2021 ◽  
Vol 63 (1) ◽  
pp. 177-177
Keyword(s):  
Ab Initio ◽  
Ab Initio Calculation ◽  
Half Metal

Ab-initio Calculation of Half-Metal Ferrimagnetic Sn0.9Mn0.05Co0.05O2

2012 ◽  
Vol 25 (6) ◽  
pp. 2069-2074 ◽  
Author(s):  
O. Mounkachi ◽  
E. Salmani ◽  
H. El Moussaoui ◽  
M. Hamedoun ◽  
H. Ez-Zahraouy ◽  
...  
Keyword(s):  
Ab Initio ◽  
Ab Initio Calculation ◽  
Half Metal

AB INITIO CALCULATION OF NH3 SPECTRUM

2016 ◽  
Author(s):  
Oleg Polyansky ◽  
Nikolay Zobov ◽  
Andrey Yachmenev ◽  
Sergei Yurchenko ◽  
Jonathan Tennyson ◽  
...  
Keyword(s):  
Ab Initio ◽  
Ab Initio Calculation

Atomic and Electronic Structure of Boron-Doped Diamond Grain Boundaries Studied by Arhvtem and ab-Initio Calculation

2003 ◽  
Vol 764 ◽  
Author(s):  
Hiroyuki Togawa ◽  
Hideki Ichinose
Keyword(s):  
Ab Initio ◽  
Grain Boundaries ◽  
Ab Initio Calculation ◽  
Structure Model ◽  
Boron Doped Diamond ◽  
Boron Doped ◽  
Transmission Electron ◽  
Diamond Grain ◽  
Electron Energy Loss ◽  
Atomic And Electronic Structure

AbstractAtomic resolution high-voltage transmission electron microscopy and electron energy loss spectroscopy were performed on grain boundaries of boron-doped diamond, cooperated with the ab-initio calculation. Segregated boron in the {112}∑3 boundary was caught by the EELS spectra. The change in atomic structure of the segregated boundary was successfully observed from the image by ARHVTEM. Based on the ARHVTEM image, a segregted structure model was proposed.

scholarly journals Ab Initio Calculation of Surface Thermochemistry for Popular Solid Transition Metal-Based Species

ACS Omega ◽  
2021 ◽  
Author(s):  
Muhammad Fahad Arshad ◽  
Ling-Nan Wu ◽  
Achraf El Kasmi ◽  
Wu Qin ◽  
Zhen-Yu Tian
Keyword(s):  
Transition Metal ◽  
Ab Initio ◽  
Ab Initio Calculation
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