声子
物理
哈密顿量(控制论)
齐次空间
点反射
凝聚态物理
几何学
数学
数学优化
作者
Meng Wang,Yu Wang,Zhiyong Yang,Jing Fan,Baobing Zheng,Rui Wang,Xiaozhi Wu
出处
期刊:Physical review
日期:2022-05-31
卷期号:105 (17)
被引量:1
标识
DOI:10.1103/physrevb.105.174309
摘要
Exploring unique topological states in condensed-matter systems has attracted great interest especially for the topological phonons recently. Based on the unbiased structure prediction approach combined with first-principles calculations, the long-sought crystal structure of ${\mathrm{Th}}_{2}{\mathrm{BC}}_{2}$ is determined. Most importantly, we show by the symmetry analysis and the phonon tight-binding Hamiltonian that ${\mathrm{Th}}_{2}{\mathrm{BC}}_{2}$ hosts nodal surface phonons on the ${q}_{z}=\ifmmode\pm\else\textpm\fi{}\ensuremath{\pi}$ plane, coexisting with nodal line phonons on the ${q}_{y}=0$ and ${q}_{y}=\ifmmode\pm\else\textpm\fi{}\ensuremath{\pi}$ planes, consequently, forming cagelike phonons. The nodal surface phonons are protected by the screw axis ${\stackrel{\ifmmode \tilde{}\else \~{}\fi{}}{C}}_{2z}$, and the nodal line phonons are enforced by inversion and time-reversal symmetries, demonstrated by the codimension argument and the effective model analysis. In addition, we also investigate the phonon surface states and the isofrequency arc on the (100) surface, which benefit the confirmation of the nodal cage phonons in experiments. Our paper not only determines the long-sought crystal structure of ${\mathrm{Th}}_{2}{\mathrm{BC}}_{2}$, but also provides an ideal candidate to realize the exotic topological phonon excitations.
科研通智能强力驱动
Strongly Powered by AbleSci AI