Department of Electrical and Computer Engineering, Isfahan University of Technology.84156-83111, Isfahan, Iran;
Department of Physics, Isfahan University of Technology,84156-83111, Isfahan, Iran;
Department of Electrical and Computer Engineering, Isfahan University of Technology.84156-83111, Isfahan, Iran;
Shiraz Nanotechnology Research Institute, Shiraz University, Shiraz, Iran;
Shiraz Nanotechnology Research Institute, Shiraz University, Shiraz, Iran;
Single wall (8, 0) carbon nanotube; Density functional theory; Oxygen molecule adsorption; Work function; Hole doping;
机译:碳纳米管上叶酸吸附的结构和电子性质:密度泛函理论研究
机译:基于密度的功能理论的吡咯烷官能化单壁碳纳米管上吉西他滨吸毒的结构,拓扑和电子性质分析
机译:氢(5,0)单壁碳纳米管上原子氧,O_2和O_3吸附的密度泛函理论研究
机译:氧分子吸附对(8,0)碳纳米管结构和电性能的影响:密度官能研究
机译:从头密度函数研究石墨烯和碳纳米管上钾原子和团簇的吸附。
机译:密度泛函理论研究含氧官能团对碳质材料上吸附的氧分子和氧原子的影响
机译:CH3COOH在(6,0),(7,0)和(8,0)锯齿形,(4,4)和(5,5)扶手单壁碳纳米管上的吸附性能:密度泛函研究