The electronic properties of twinned ZnS nanowires （NWs） with different diameters were investigated based on first-principles calculations. The energy band structures, projected density of states and the spatial dis...The electronic properties of twinned ZnS nanowires （NWs） with different diameters were investigated based on first-principles calculations. The energy band structures, projected density of states and the spatial distributions of the bottom of conduction band and the top of the valence band were presented. The results show that the twinned nanowires exhibit a semiconducting character and the band gap decreases with increasing nanowire diameter due to quantum confinement effects. The valence band maximum and conduction band minimum originate mainly from the S-p and Zn-s orbitals at the core of the nanowires, respectively, which was confirmed by their spatial charge density distribution. We also found that no heterostructure is formed in the twinned ZnS NWs since the valence band maximum and conduction band minimum states are distributed along the NW axis uniformly. We suggest that the hexagonal （2H） stacking inside the cubic （3C） stacking has no effect on the electronic properties of thin ZnS NWs.展开更多
A series solution of displacement response of the ground surface in the presence of underground twin tunnels subjected to excitation of incident plane SV waves is derived by using Fourier-Bessel series expansion metho...A series solution of displacement response of the ground surface in the presence of underground twin tunnels subjected to excitation of incident plane SV waves is derived by using Fourier-Bessel series expansion method.The numerical parametric study shows that underground twin tunnels significantly amplify the nearby surface ground motion.It is suggested that the effect of subways on ground motion should be considered when the subways are planned and designed.展开更多
La1-x Sr x MnO3(LSMO)锰氧化物由于具有显著的庞磁电阻效应而被广泛关注,但少量Mn3O4杂质相会破坏其磁电阻效应.采用透射电子显微术及其相关分析方法,系统表征了杂质相Mn3O4中的微孪晶结构,并分析其形成机制.研究发现,在具有锐钛矿结构...La1-x Sr x MnO3(LSMO)锰氧化物由于具有显著的庞磁电阻效应而被广泛关注,但少量Mn3O4杂质相会破坏其磁电阻效应.采用透射电子显微术及其相关分析方法,系统表征了杂质相Mn3O4中的微孪晶结构,并分析其形成机制.研究发现,在具有锐钛矿结构的Mn3O4中,微孪晶的孪晶面为(112)面,且孪晶面附近含有少量Sr原子;孪晶面出现几率与Sr原子含量之间的关系表明,孪晶的形成归因于少量Sr原子降低了孪晶界面形成能,这有助于推测出从锐钛矿向钙钛矿发生结构演化的一般规律.展开更多
基金Project supported by the Special Funds of the National Natural Science Foundation of China (Grant No. 10947102)the Foundation of the Education Committee of Chongqing (Grant No. KJ090503)
文摘The electronic properties of twinned ZnS nanowires （NWs） with different diameters were investigated based on first-principles calculations. The energy band structures, projected density of states and the spatial distributions of the bottom of conduction band and the top of the valence band were presented. The results show that the twinned nanowires exhibit a semiconducting character and the band gap decreases with increasing nanowire diameter due to quantum confinement effects. The valence band maximum and conduction band minimum originate mainly from the S-p and Zn-s orbitals at the core of the nanowires, respectively, which was confirmed by their spatial charge density distribution. We also found that no heterostructure is formed in the twinned ZnS NWs since the valence band maximum and conduction band minimum states are distributed along the NW axis uniformly. We suggest that the hexagonal （2H） stacking inside the cubic （3C） stacking has no effect on the electronic properties of thin ZnS NWs.
基金National Natural Science Foundation of China(50378063)EYTP of MOESRF for ROCS,MOE
文摘A series solution of displacement response of the ground surface in the presence of underground twin tunnels subjected to excitation of incident plane SV waves is derived by using Fourier-Bessel series expansion method.The numerical parametric study shows that underground twin tunnels significantly amplify the nearby surface ground motion.It is suggested that the effect of subways on ground motion should be considered when the subways are planned and designed.
文摘La1-x Sr x MnO3(LSMO)锰氧化物由于具有显著的庞磁电阻效应而被广泛关注,但少量Mn3O4杂质相会破坏其磁电阻效应.采用透射电子显微术及其相关分析方法,系统表征了杂质相Mn3O4中的微孪晶结构,并分析其形成机制.研究发现,在具有锐钛矿结构的Mn3O4中,微孪晶的孪晶面为(112)面,且孪晶面附近含有少量Sr原子;孪晶面出现几率与Sr原子含量之间的关系表明,孪晶的形成归因于少量Sr原子降低了孪晶界面形成能,这有助于推测出从锐钛矿向钙钛矿发生结构演化的一般规律.
