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Theoretical realization of Mo2P, a novel stable 2D material with superionic conductivity and attractive optical properties
Bohayra Mortazavi, Masoud Shahrokhi, Meysam Makaremi +1
Mo2P as a new member of the advancing two-dimensional (2D) materials family has been theoretically identified in this study. We conducted extensive density functional theory calcul…
Electronic, optical and thermal properties of highly stretchable 2D carbon Ene-yne graphyne
Bohayra Mortazavi, Masoud Shahrokhi, Timon Rabczuk +1
Recently, a new carbon-based two-dimensional (2D) material, so called "carbon Ene-yne" (CEY), was successfully synthesized. In this work, we examine electronic, optical and thermal…
Constructing IGA-suitable planar parameterization from complex CAD boundary by domain partition and global/local optimization
Gang Xu, Ming Li, Bernard Mourrain +3
In this paper, we propose a general framework for constructing IGA-suitable planar B-spline parameterizations from given complex CAD boundaries consisting of a set of B-spline curv…
An improved isogeometric analysis method for trimmed geometries
Jinlan Xu, Ningning Sun, Laixin Shu +2
Trimming techniques are efficient ways to generate complex geometries in Computer-Aided Design(CAD). In this paper, an improved isogeometric analysis(IGA) method for trimmed geomet…
Graphene or h-BN paraffin composite structures for the thermal management of Li-ion batteries: A multiscale investigation
Bohayra Mortazavi, Hongliu Yang, Farzad Mohebbi +2
The reliability and safety of lithium-ion batteries can be affected by overheating issues. Phase change materials like paraffin due to their large heat capacities are among the bes…
Anomalous strain effect on the thermal conductivity of borophene: a reactive molecular dynamics study
Bohayra Mortazavi, Minh-Quy Le, Timon Rabczuk +1
Borophene, an atomically thin, corrugated, crystalline two-dimensional boron sheet, has been recently synthesized. We investigate mechanical properties and lattice thermal conducti…