Various Electrode Configurations Effect on the Electronic Transport of CNT/Benzene/CNT System by DFT-NEGF Method
Author:
Publisher
Springer Science and Business Media LLC
Subject
General Physics and Astronomy,General Mathematics,General Earth and Planetary Sciences,General Agricultural and Biological Sciences,General Chemistry
Link
https://link.springer.com/content/pdf/10.1007/s40995-021-01178-1.pdf
Reference43 articles.
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3. Berdiyorov GR, Eshonqulov G, Hamoudi H (2020) Electronic transport of CNT-encapsulated carbyne. Comput Mater Sci 183:109809. https://doi.org/10.1016/j.commatsci.2020.109809
4. Brandbyge M, Mozos JL, Ordejón P, Taylor J, Stokbro K (2002) Density-functional method for nonequilibrium electron transport. Phys Rev B 65(16):165401. https://doi.org/10.1103/PhysRevB.65.165401
5. Chen YR, Zhang L, Hybertsen MS (2007) Theoretical study of trends in conductance for molecular junctions formed with armchair carbon nanotube electrodes. Phys Rev B 76(11):115408. https://doi.org/10.1103/PhysRevB.76.115408
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