scholarly journals Transport properties of a three-shell icosahedral matryoshka cluster: a first-principles study

RSC Advances ◽  
2017 ◽  
Vol 7 (21) ◽  
pp. 12704-12710 ◽  
Author(s):  
Lu Zhang ◽  
Jing Huang ◽  
Weiyi Wang ◽  
Qunxiang Li ◽  
Jinlong Yang

The molecular junction based on three-shell icosahedral matryoshka cluster with huge magnetic moment exhibits robust spin-filtering effect, which highlights it for promising applications in molecular devices.

2017 ◽  
Vol 48 ◽  
pp. 357-364 ◽  
Author(s):  
Liemao Cao ◽  
Xiaobo Li ◽  
Guang Liu ◽  
Ziran Liu ◽  
Guanghui Zhou

2014 ◽  
Vol 1015 ◽  
pp. 389-392
Author(s):  
Y.H. Zhou ◽  
L.L. Zhou ◽  
X.H. Qiu ◽  
Y.L. Peng

The transport properties of transition metal atoms interfered alpha-graphyne nanoribbon systems are investigated by first-principles calculations combined with the Keldysh nonequilibrium Green’s method. In all, five types of configurations are considered. We find that intervention of three Cr atom in alpha-graphyne nanoribbon systems decreases the conductivity of the system. Further study show that the magnetic direction of the electrode infulence the spin filtering effect greatly, while the ralative magnetic direction of the three transition Cr atoms have little effect on the transport properties. At finite bias window, negative differential resistance happens. Proper analysis are given to explain the spin filtering phenonmenon and the different transport properties via transmission coefficient and projected density of states.


2018 ◽  
Vol 20 (32) ◽  
pp. 21105-21112 ◽  
Author(s):  
Si-Cong Zhu ◽  
Shun-Jin Peng ◽  
Kai-Ming Wu ◽  
Cho-Tung Yip ◽  
Kai-Lun Yao ◽  
...  

We investigate the electronic and transport properties of vanadium-doped zigzag blue phosphorus nanoribbons by first-principles quantum transport calculations.


2014 ◽  
Vol 2 (32) ◽  
pp. 6648-6654 ◽  
Author(s):  
P. Zhao ◽  
Q. H. Wu ◽  
H. Y. Liu ◽  
D. S. Liu ◽  
G. Chen

The 4H-TAHDI-based spintronic device can exhibit perfect giant magnetoresistance, spin-filtering, bipolar spin-rectifying, and negative differential resistance effects simultaneously.


Author(s):  
Ho Ngoc Nam ◽  
Ryo Yamada ◽  
Haruki Okumura ◽  
Tien Quang Nguyen ◽  
Katsuhiro Suzuki ◽  
...  

Correction for ‘Intrinsic defect formation and the effect of transition metal doping on transport properties in a ductile thermoelectric material α-Ag2S: a first-principles study’ by Ho Ngoc Nam et al., Phys. Chem. Chem. Phys., 2021, DOI: 10.1039/d0cp06624a.


2021 ◽  
Vol 129 (3) ◽  
pp. 035302
Author(s):  
Mengli Yao ◽  
Xiaojiao Zhang ◽  
Tian Wu ◽  
Biao Liu ◽  
Mingjun Li ◽  
...  

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