Spin-polarized electronic structure for the layered two-dimensional[FeII(TCNE)(NCMe)2][FeIIICl4]organic-based magnet

2009 ◽  
Vol 80 (6) ◽  
Author(s):  
William W. Shum ◽  
Arthur J. Epstein ◽  
Joel S. Miller
1989 ◽  
Vol 151 ◽  
Author(s):  
Roy Richter ◽  
Jack G. Gay

ABSTRACTLarge anisotropy energy is an essential property of high quality permanent magnets. In previous work we have calculated the spin polarized electronic structure and anisotropy of monolayers and slabs of Fe, Ni, and V. In this work we calculate the dependence on temperature of the spin anisotropy of a ferromagnetic monolayer of Fe. We find the easy direction of magnetization is not sensitive to the temperature; the variations calculated here are likely too small to be observed. It is perpendicular to the plane of the surface for both low and high temperatures. The calculations become progressively more ill-behaved as the temperatures are lowered and require more computer time for satisfactory convergence.For Fe/Cu {100}, we find the spins always prefer to point out of plane. Experimental results in general are consistent with this view, although the systems seem to be difficult to prepare.


2021 ◽  
Vol 555 ◽  
pp. 149516
Author(s):  
Jacek J. Kolodziej ◽  
Dawid Wutke ◽  
Jakub Lis ◽  
Natalia Olszowska

2021 ◽  
Vol 23 (10) ◽  
pp. 6171-6181
Author(s):  
Yaoqi Gao ◽  
Baozeng Zhou ◽  
Xiaocha Wang

It is found that the biaxial strain, electric field and interlayer distance can effectively modulate the electronic structure and magnetic properties of two-dimensional van der Waals heterostructures.


2021 ◽  
Vol 12 (1) ◽  
Author(s):  
Jun Yin ◽  
Rounak Naphade ◽  
Partha Maity ◽  
Luis Gutiérrez-Arzaluz ◽  
Dhaifallah Almalawi ◽  
...  

AbstractHot-carrier cooling processes of perovskite materials are typically described by a single parabolic band model that includes the effects of carrier-phonon scattering, hot phonon bottleneck, and Auger heating. However, little is known (if anything) about the cooling processes in which the spin-degenerate parabolic band splits into two spin-polarized bands, i.e., the Rashba band splitting effect. Here, we investigated the hot-carrier cooling processes for two slightly different compositions of two-dimensional Dion–Jacobson hybrid perovskites, namely, (3AMP)PbI4 and (4AMP)PbI4 (3AMP = 3-(aminomethyl)piperidinium; 4AMP = 4-(aminomethyl)piperidinium), using a combination of ultrafast transient absorption spectroscopy and first-principles calculations. In (4AMP)PbI4, upon Rashba band splitting, the spin-dependent scattering of hot electrons is responsible for accelerating hot-carrier cooling at longer delays. Importantly, the hot-carrier cooling of (4AMP)PbI4 can be extended by manipulating the spin state of the hot carriers. Our findings suggest a new approach for prolonging hot-carrier cooling in hybrid perovskites, which is conducive to further improving the performance of hot-carrier-based optoelectronic and spintronic devices.


2021 ◽  
pp. 100473
Author(s):  
Hyun Yong Song ◽  
Byung Il Yoo ◽  
Jin-Ho Choi ◽  
Se-Hwang Kang ◽  
Joonho Bang ◽  
...  

1995 ◽  
Vol 384 ◽  
Author(s):  
Zhi-Qiang Li ◽  
Yuichi Hashi ◽  
Jing-Zhi Yu ◽  
Kaoru Ohno ◽  
Yoshiyuki Kawazoe

ABSTRACTThe electronic structure and magnetic properties of rhodium clusters with sizes of 1 - 43 atoms embedded in the nickel host are studied by the first-principles spin-polarized calculations within the local density functional formalism. Single Rh atom in Ni matrix is found to have magnetic moment of 0.45μB. Rh13 and Rhl 9 clusters in Ni matrix have lower magnetic moments compared with the free ones. The most interesting finding is tha.t Rh43 cluster, which is bulk-like nonmagnetic in vacuum, becomes ferromagnetic when embedded in the nickel host.


2016 ◽  
Vol 18 (45) ◽  
pp. 30946-30953 ◽  
Author(s):  
Damien Magne ◽  
Vincent Mauchamp ◽  
Stéphane Célérier ◽  
Patrick Chartier ◽  
Thierry Cabioc'h

The role of the surface groups in chemical bonding in two dimensional Ti3C2is evidenced at the nano-object level.


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