scholarly journals Heteroatom Effects on Quantum Interference in Molecular Junctions: Modulating Antiresonances by Molecular Design

Author(s):  
Luke J. O’Driscoll ◽  
Sara Sangtarash ◽  
Wei Xu ◽  
Abdalghani Daaoub ◽  
Wenjing Hong ◽  
...  
Author(s):  
Lin Huang ◽  
Yu-Jia Zeng ◽  
Dan Wu ◽  
Nan-Nan Luo ◽  
Ye-Xin Feng ◽  
...  

Achieving high tunneling magnetoresistance (TMR) in molecular-scale junctions is attractive for their applications in spintronics. By using density-functional theory (DFT) in combination with the nonequilibrium Green's function (NEGF) method, we...


2020 ◽  
Vol 6 (12) ◽  
pp. 2000689
Author(s):  
Lin Huang ◽  
Shi‐Zhang Chen ◽  
Yu‐Jia Zeng ◽  
Dan Wu ◽  
Bo‐Lin Li ◽  
...  

2019 ◽  
Vol 99 (11) ◽  
Author(s):  
Dongzhe Li ◽  
Rajdeep Banerjee ◽  
Sourav Mondal ◽  
Ivan Maliyov ◽  
Mariya Romanova ◽  
...  

2019 ◽  
Vol 10 (20) ◽  
pp. 6419-6424 ◽  
Author(s):  
Saman Naghibi ◽  
Ali K. Ismael ◽  
Andrea Vezzoli ◽  
Mohsin K. Al-Khaykanee ◽  
Xijia Zheng ◽  
...  

2014 ◽  
Vol 89 (8) ◽  
Author(s):  
Troels Markussen ◽  
Kristian S. Thygesen

2015 ◽  
Vol 17 (48) ◽  
pp. 32099-32110 ◽  
Author(s):  
Tomofumi Tada ◽  
Kazunari Yoshizawa

In this study, we report our viewpoint of single molecular conductance in terms of frontier orbitals.


2016 ◽  
Vol 6 (1) ◽  
Author(s):  
C. Bessis ◽  
M. L. Della Rocca ◽  
C. Barraud ◽  
P. Martin ◽  
J. C. Lacroix ◽  
...  

Nano Letters ◽  
2020 ◽  
Vol 20 (4) ◽  
pp. 2843-2848 ◽  
Author(s):  
Suman Gunasekaran ◽  
Julia E. Greenwald ◽  
Latha Venkataraman

2013 ◽  
Vol 15 (33) ◽  
pp. 13951 ◽  
Author(s):  
Daijiro Nozaki ◽  
Hâldun Sevinçli ◽  
Stanislav M. Avdoshenko ◽  
Rafael Gutierrez ◽  
Gianaurelio Cuniberti

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