TY - JOUR T1 - Electronic Transport Behavior of the Closed and Open-Shell Forms of Polychlorotrimethylphenyl JO - Communications in Computational Chemistry VL - 2 SP - 145 EP - 151 PY - 2013 DA - 2013/01 SN - 1 DO - http://doi.org/10.4208/cicc.2013.v1.n2.5 UR - https://global-sci.org/intro/article_detail/cicc/381.html KW - current switching, contact sites, nonequilibrium Green’s function, density functional theory, electronic transport. AB -