Strain control of orbital polarization and correlated metal-insulator transition in La(2)CoMnO(6) from first principles
文献类型:期刊论文
作者 | Lv SH ; Li HP ; Wang ZC ; Han L ; Liu Y ; Liu XJ ; Meng J |
刊名 | applied physics letters
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出版日期 | 2011 |
卷号 | 99期号:20 |
关键词 | MN/CO ATOMIC ORDER MAGNETIC-PROPERTIES STATE LAMN0.5CO0.5O3+DELTA LA2NIMNO6 ENERGY OXIDES |
ISSN号 | 0003-6951 |
通讯作者 | lv sh |
中文摘要 | transition metal oxides show rich physical properties which are often influenced by external perturbation. here, we report by first-principles calculations that strain enables switching of orbital occupancy of co(2+) in la(2)comno(6) and hence modifies electronic structure of la(2)comno(6). we find a metal-insulator transition in la(2)comno(6), which originates from the interplay between the strain induced lattice distortion and electron correlations. such transition is understood upon the orbital polarization of co(2+), which takes on the d(xz/yz) character under compression, yet switches to the d(x2-y2) character under tension. the orbital switching presented should hold promise for many technological applications. (c) 2011 american institute of physics. [doi: 10.1063/1.3662859] |
收录类别 | SCI收录期刊论文 |
语种 | 英语 |
公开日期 | 2012-06-08 |
源URL | [http://ir.ciac.jl.cn/handle/322003/44226] ![]() |
专题 | 长春应用化学研究所_长春应用化学研究所知识产出_期刊论文 |
推荐引用方式 GB/T 7714 | Lv SH,Li HP,Wang ZC,et al. Strain control of orbital polarization and correlated metal-insulator transition in La(2)CoMnO(6) from first principles[J]. applied physics letters,2011,99(20). |
APA | Lv SH.,Li HP.,Wang ZC.,Han L.,Liu Y.,...&Meng J.(2011).Strain control of orbital polarization and correlated metal-insulator transition in La(2)CoMnO(6) from first principles.applied physics letters,99(20). |
MLA | Lv SH,et al."Strain control of orbital polarization and correlated metal-insulator transition in La(2)CoMnO(6) from first principles".applied physics letters 99.20(2011). |
入库方式: OAI收割
来源:长春应用化学研究所
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