Theory of charge transport in molecular junctions:from Coulomb blockade to coherent tunneling

来源 :第十二届全国量子化学会议 | 被引量 : 0次 | 上传用户:zhou75610141
下载到本地 , 更方便阅读
声明 : 本文档内容版权归属内容提供方 , 如果您对本文有版权争议 , 可与客服联系进行内容授权或下架
论文部分内容阅读
  We study charge transport through molecular junctions in the presence of electron-electron interaction by using nonequilibrium Greens function(NEGF)techniques and renormalized perturbation theory.In the perturbation treatment,the zeroth-order Hamiltonian of the molecular junction is composed of a collection of single-impurity Andersons models,which act as the channels where charges come through or occupy,and the interactions between different channels are treated as the perturbation.With this scheme,the effects of molecule-lead interaction,electron-electron interaction and hopping interaction are included nonperturbatively,and the charge transport process can be studied in the intermediate parameter range from Coulomb blockade regime to coherent tunneling regime.The concept of quasi-particle is introduced to describe the kinetic process of charge transport,and then two electric current transport mechanisms,sequential tunneling and coherent tunneling,can be distinguished and calculated.As a test study,the Hubbard model is used as the molecular Hamiltonian to simulate dimeric and trimeric molecular junctions.Various nonlinear current-voltage characteristics,including Coulomb blockade,negative differential resistance,rectification and current hysteresis,are shown in the calculations,and the mechanisms are elucidated.
其他文献
  The mechanism of the Sakurai-Hosomi allylation reaction between isatin as well as ketoimine with allyltrimethylsilane in the presence of Hg(ClO4)2 has been
会议
水稻条纹叶枯病和水稻黑条矮缩病是在水稻上普遍发生、危害严重的病毒病。水稻条纹叶枯病病的病原为水稻条纹病毒(Rice stripe virus, RSV)。RSV侵染水稻后,心叶褪绿、出现捻转,
  To understand the codoping effects on the photocatalytic activities of Zn2GeO4 with wide band gap,we make a thorough investigation on the electronic structu
会议
作为大脑边缘系统的关键组成部分,杏仁核在高等动物(包括人类)的情感形成和表达过程中发挥着不可或缺的作用。通过接收并整合海马、皮层以及丘脑等周围脑区的信息输入,杏仁核将周
使用语料库研究方法,对比英语本族语学者与中国学生农科硕博论文摘要,探讨中国学生科技语篇使用动词名词化结构的特征。研究结果显示,中国学生在论文写作中动词名词化手段总
《英语学习》线上系列沙龙迎来了一年中里程碑式的一期—— 第24期,主题是“基础外语教育回顾与展望”,主持人和嘉宾围绕“回顾和展望”两个分话题展开了讨论。回顾:(1)2015—2016学年,我们在教师发展方面做了哪些工作?有哪些进展?哪些创新?还存在哪些问题?(2)2015—2016学年,我们在考试与评价方面发生了哪些变化?有哪些突破?还存在哪些问题?展望:(1)英语学科核心素养如何在教学一线落地?
期刊
MicroRNAs(miRNAs)是一类非编码的长约21-25nt的单链小RNA分子,线虫、果蝇、家蚕、人及拟南芥等生物中普遍存在。miRNA通过与靶基因mRNA特异性结合,诱导靶基因mRNA的降解或抑制
键盘乐器即兴伴奏是音乐教育、特别是师范院系技能课程的支柱学科之一,同时,也是音乐专业学习者的音乐基本功、艺术感觉等基本素质的重要衡量指标之一.多年以来,本人通过对键
  The cleavage and functionalization of azoles C-H bonds have attracted considerable attention due to the promising transformation into valuable compounds[1].
会议
英语绘本是适合初中阶段学生的英语阅读材料.在英语绘本中,英语语言文字与相关的插图相辅相成,共同组成了一则则能够有效激发学生学习兴趣的英语故事.这些英文绘本故事或趣味
期刊