12 citations · 25 across the 7 of their papers we have counts for
7 papers · 1 filter
Appraising the absolute limits of nanotubes and nanospheres to preserve high-pressure materials
Yin L. Xu, Guang F. Yang, Yi Sun +5
Matter under high pressure often exhibits attractive properties, which, unfortunately, are typically irretrievable when released to ambient conditions. Intuitively, nanostructure e…
He-Mg compounds and helium-driven nonmetal transition in metallic magnesium
Y. S. Huang, H. X. Song, Q. D. Hao +6
The polymorphism and mechanism of helium compounds is crucial for understanding the physical and chemical nature of He-bearing materials under pressures. Here, we predict two new t…
Simultaneous Superconducting and Topological Properties in Mg-Li Electrides at High Pressures
D. Wang, H. Song, Q. Hao +6
Electrides as a unique class of emerging materials exhibit fascinating properties and hold important significance for understanding the matter under extreme conditions, which is ch…
Theoretical Study on the Structural and Thermodynamic Properties of U-He compounds under High Pressure
Ye Cao, Hongxing Song, Xiaozhen Yan +6
Uranium is considered as a very important nuclear energy material because of the huge amount of energy released. As the main products of spontaneous decay of uranium, helium is dif…
First-principles study of structural and electronic properties of multiferroic oxide Mn3TeO6 under high pressure
Xiao-Long Pan, Hao Wang, Lei Liu +2
Mn3TeO6 (MTO) has been experimentally found to adopt a P21/n structure under high pressure, which exhibits a significantly smaller band gap compared to the atmospheric R-3 phase. I…
Topological and superconducting properties of two-dimensional C6-2x(BN)x biphenylene network: a first-principles investigation
Guang F. Yang, Hong X. Song, Dan Wang +2
First-principles calculations have been used to investigate the electronic and topological properties of the two-dimensional C6-2x(BN)x biphenylene network, a graphene-like structu…
Universal Metallic Surface States in Electride
Dan Wang, Hongxing Song, Leilei Zhang +6
Robust metallic surface states (MSS) of topological insulator (TI) against imperfections and perturbations are important in broad applications such as chemical catalysis and quantu…