First principle approach to elucidate transport properties through l-glutamic acid-based molecular devices using symmetrical electrodes

2020 ◽  
Vol 26 (4) ◽  
Author(s):  
Gaurav Sikri ◽  
Ravinder Singh Sawhney
Keyword(s):  
Glutamic Acid ◽  
Transport Properties ◽  
Molecular Devices ◽  
First Principle

Structural, electronic, optoelectronic and transport properties of LuZnCuAs2 compound: First principle calculations under DFT

2020 ◽  
Vol 596 ◽  
pp. 412351
Author(s):  
M. Waqas Iqbal ◽  
Mumtaz Manzoor ◽  
Hira Ateeq ◽  
Sikander Azam ◽  
Ghulam Murtaza ◽  
...  
Keyword(s):  
Transport Properties ◽  
First Principle ◽  
First Principle Calculations

scholarly journals Distinctive electronic transport in pyridine-based devices with narrow graphene nanoribbon electrodes

RSC Advances ◽  
2017 ◽  
Vol 7 (85) ◽  
pp. 53696-53705 ◽  
Author(s):  
Jie Li ◽  
Yunrui Duan ◽  
Yi Zhou ◽  
Tao Li ◽  
Zhenyang Zhao ◽  
...  
Keyword(s):  
Electron Transport ◽  
Transport Properties ◽  
Electronic Transport ◽  
Graphene Nanoribbon ◽  
Molecular Devices ◽  
Electron Transport Properties ◽  
Non Equilibrium

Two kinds of pyridine-based molecular devices with the same narrow ZGNR electrodes show different and distinctive non-equilibrium electron transport properties.

The Spin Transport of the Coblt Dimers with Different Directions

2014 ◽  
Vol 543-547 ◽  
pp. 3947-3950
Author(s):  
Shi Wei Ren
Keyword(s):  
Transport Properties ◽  
Spin Polarization ◽  
Density Of States ◽  
Bias Voltage ◽  
Spin Transport ◽  
First Principle ◽  
Transport Direction ◽  
Spin Polarized ◽  
Analysis Calculation

In this paper, the spin transport properties of the coblt dimers parrallel to the transport direction and perpendicular to ransprot direction are investigated by using the first principle analysis. Calculation shows that both the coblt dimers parrallel to the transport direction and perpendicular to ransprot direction give obvious spin polarized density of states and current. It is found that the dimer parrallel to the transport direction have larger spin polarization current.The spin polarized efficiency for the parrallel dimer increase steadily with the increase of the bias voltage. But the the spin polarization for the transverse dimer changes greatly.

Effect of boron/nitrogen co-doping on transport properties of C60 molecular devices

2013 ◽  
Vol 20 (4) ◽  
pp. 889-893
Author(s):  
Xiao-zan Wu ◽  
Guang-hui Huang ◽  
Qing-bin Tao ◽  
Hui Xu
Keyword(s):  
Transport Properties ◽  
Molecular Devices ◽  
Co Doping ◽  
Boron Nitrogen
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