Phosphorene相关论文
We have investigated the electronic and magnetic properties of zigzag phosphorene nanoribbons(ZPNRs)with transi-tion met......
Activity origin and design principles for atomic vanadium anchoring on phosphorene monolayer for nit
Conversion of inert N2 molecules into NH3 via electrochemical methods is an environmentally friendly alternative to repl......
The electrochemical ammonia synthesis has attracted increasing attention due to its energy saving characteristics.Howeve......
A large number of two-dimensional (2D) monoelemental materials with huge application potentials have been developed,sinc......
First-principles investigation of structural and electronic properties of oxygen adsorbing phosphore
Two-dimensional (2D) phosphorene has been extensively studied for potential electronic and optoelectronic applications. ......
利用第一性原理赝势平面波方法计算了杂质(X=C,Al)掺杂新型二维材料磷烯的结构参数、能带结构、Mulliken布居分析、差分电荷密度以......
本文基于第一性原理研究了Fe、Co、Ni在P位吸附和掺杂磷烯的稳定性、能带结构、态密度以及差分电荷密度分布.结果表明：在吸附体系中......
石墨烯的零带隙和二硫化钼载流子迁移率低的性质阻碍了它们在电子器件中的应用。单层黑磷的成功制备和磷烯的直接带隙、较高的载流......
基于紧束缚近似方法计算磷烯低能有效哈密顿的Berry相位,并与石墨烯的Berry相位进行了对比.研究了外加磁场对磷烯Berry相位的影响,......
硅基锂离子负极材料在脱嵌锂离子的过程中显著的体积效应导致活性材料的粉化、固体电解质介面膜（SEI）的持续生长和电接触的丧失并最......
随着钠离子电池的兴起,对其电极材料的研究也越来越引起学者们的关注。本文从实验出发,首先进行了磷烯-石墨烯混合材料的制备,然后......
为了研究以磷烯为材料的T型三端弹道结的电学输运特性,利用kwant软件模拟计算右端边缘分别为锯齿形和扶手椅形三端弹道结的输出电......
磷烯不仅具有密度小、优良的导电性,导热性及良好柔性性能,而且还能够与硅晶体及硅烯完全相容,利用它的这些特点及石墨烯、锡烯、......
