论文标题

在两个非磁性五价蜂窝状的电子基态下

On the electronic ground state of two non-magnetic pentavalent honeycomb iridates

论文作者

de la Torre, A., Zager, B., Chamorro, J. R., Upton, M. H., Fabbris, G., Haskel, D., Casa, D., McQueen, T. M., Plumb, K. W.

论文摘要

我们研究了两个IR $^{5+} $ Honeycomb iridates的电子结构,SR $ _3 $ CAIR $ _2 $ o $ _9 $和NAIRO $ _3 $,通过谐振X射线技术。我们确认SR $ _3 $ CAIR $ _2 $ o $ _9 $实现了一个大型旋转轨道驱动的非磁性$ J = 0 $ singlet基态,尽管IR协调八面体的四方扭曲很大。另一方面,NAIAO $ _3 $的共振非弹性X射线光谱与对具有八面体配位的IR $^{5+} $的莫特绝缘子的期望大不相同。我们发现,NAIAO $ _3 $的数据可以最好地解释为源自狭窄的间隙非磁性$ S = 0 $ band绝缘地面状态。我们的结果突出了配体环境在蜂窝虹膜电子结构中的复杂作用,以及X射线光谱法对表征绝缘材料的电子接地态的重要作用。

We investigate the electronic structure of two Ir$^{5+}$ honeycomb iridates, Sr$_3$CaIr$_2$O$_9$ and NaIrO$_3$, by means of resonant x-ray techniques. We confirm that Sr$_3$CaIr$_2$O$_9$ realizes a large spin-orbit driven non-magnetic $J = 0$ singlet ground state despite sizable tetragonal distortions of Ir coordinating octahedra. On the other hand, the resonant inelastic x-ray spectra of NaIrO$_3$ are drastically different from expectations for a Mott insulator with octahedrally coordinated Ir$^{5+}$. We find that the data for NaIrO$_3$ can be best interpreted as originating from a narrow gap non-magnetic $S = 0$ band insulating ground state. Our results highlight the complex role of the ligand environment in the electronic structure of honeycomb iridates and the essential role of x-ray spectroscopy to characterize electronic ground states of insulating materials.

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