233 citations · 470 across the 7 of their papers we have counts for
7 papers
Strain effects on monolayer MoSi2N4: ideal strength and failure mechanism
Qingfang Li, Wanxin Zhou, Xiangang Wan +1
Recently, two-dimensional monolayer MoSi2N4 with hexagonal structure was successfully synthesized in experiment (Hong et al 2020 Science 369, 670). The fabricated monolayer MoSi2N4…
High intrinsic lattice thermal conductivity in monolayer MoSiN
Jihai Yu, Jian Zhou, Xiangang Wan +1
Very recently, a novel two-dimension (2D) MXene, MoSiN, was successfully synthesized with excellent ambient stability, high carrier mobility, and moderate band gap (Science…
Ultra-high Hydrogen Storage Capacity of Holey Graphyne
Yan Gao, Huanian Zhang, Hongzhe Pan +3
Holey graphyne (HGY), a novel 2D single-crystalline carbon allotrope, was synthesized most recently by Castro-Stephens coupling reaction. The natural existing uniform periodic hole…
First-principles study of phononic thermal transport in monolayer C3N: a comparison with graphene
Yan Gao, Haifeng Wang, Maozhu Sun +4
Very recently, a new graphene-like crystalline, hole-free, 2D-single-layer carbon nitride C3N, has been fabricated by polymerization of 2,3-diaminophenazine and used to fabricate a…
Anisotropic Phonon Transport, Thermal Expansion and Thermomechanics in Monolayer Td-WTe2
Hongyi Sun, Qingfang Li
In this paper, we elaborately investigate the phonon transport, thermal expansion and thermomechanics of monolayer Td-WTe2 by using first-principles.
The Ideal Tensile Strength and Phonon Instability of Borophene
Haifeng Wang, Qingfang Li, Yan Gao +3
Very recently, two-dimensional(2D) boron sheets (borophene) with rectangular structure has been grown successfully on single crystal Ag(111) substrates.The fabricated boroprene is…
First-Principles Study of Lattice Thermal Conductivity of Td-WTe2
Gang Liu, Hong Yi Sun, Jian Zhou +2
The structural and thermal properties of bulk Td-WTe2 have been studied by using first-principles calculations. We find that the lattice thermal conductivity of WTe2 is anisotropic…