期刊
PHYSICAL REVIEW B
卷 79, 期 7, 页码 -出版社
AMER PHYSICAL SOC
DOI: 10.1103/PhysRevB.79.075119
关键词
ab initio calculations; molecular electronics; superconductivity
We study Andreev reflection in a normal conductor-molecule-superconductor junction using a first-principles approach. In particular, we focus on a family of molecules consisting of a molecular backbone and a weakly coupled side group. We show that the presence of the side group can lead to a Fano resonance in the Andreev reflection. We use a simple theoretical model to explain the results of the numerical calculations and to make predictions about the possible subgap resonance structures in the Andreev reflection coefficient.
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