Matsunaga N, Sohlberg K
Department of Chemistry and Biochemistry, Long Island University, Brooklyn, New York 11201, USA.
J Nanosci Nanotechnol. 2001 Sep;1(3):275-9. doi: 10.1166/jnn.2001.048.
We present a quantum mechanical tunneling model for electron transport through a molecular junction and address the model with the results of quantum chemical electronic structure calculations. The model gives insight into the origin of the substituent effect on the current versus applied voltage characteristics of molecular junctions.
我们提出了一种用于电子通过分子结传输的量子力学隧穿模型,并用量子化学电子结构计算结果对该模型进行了探讨。该模型揭示了取代基对分子结电流与外加电压特性影响的起源。