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Organic-inorganic hybrid coordination polymer C3H9CdCl3N co-exhibiting superior Dirac point and nodal surface states
Results in Physics ( IF 5.3 ) Pub Date : 2020-05-11 , DOI: 10.1016/j.rinp.2020.103159
Xiaotian Wang , Feng Zhou , Hong Chen

In this work, based on first-principles, we reported that synthesized organic-inorganic hybrid coordination polymer C3H9CdCl3N is an excellent topological material co-exhibiting superior Dirac point (DP) and nodal surface (NS) states. Importantly, C3H9CdCl3N enjoys the following advantages: (1) this material is easily synthesized and the high-quality compound has been obtained before; (2) this material features a DP state at K point near the Fermi level (EF), and the calculated Fermi velocity of this DP is 1.323 × 105 m/s; (3) this material exhibits NS in the kz = π plane, and the energy variation of the NS is very small; (4) Both of the DP and NS features are close to the EF; (5) In addition to the DP and NS states, there are no other energy bands near the EF. It is hoped that organic-inorganic hybrid coordination polymers C3H9CdCl3N can be seen as a good platform to further study the rich topological states in the near future.



中文翻译:

有机-无机杂化配位聚合物C 3 H 9 CdCl 3 N共展现出狄拉克点和节点表面态

在这项工作中,基于第一性原理,我们报道了合成的有机-无机杂化配位聚合物C 3 H 9 CdCl 3 N是同时具有优越的狄拉克点(DP)和节点表面(NS)状态的优良拓扑材料。重要的是,C 3 H 9 CdCl 3 N具有以下优点:(1)该材料易于合成并且以前已经获得了高质量的化合物;(2)该材料在费米能级(E F)附近的K点处具有DP状态,计算出的该DP的费米速度为1.323×10 5  m / s;(3)该材料在k z处显示NS =π平面,NS的能量变化很小;(4)DP和NS特征都接近E F;(5)除了DP和NS状态外,E F附近没有其他能带。希望将有机-无机杂化配位聚合物C 3 H 9 CdCl 3 N视为在不久的将来进一步研究丰富的拓扑状态的良好平台。

更新日期:2020-05-11
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