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6 papers · 2 filters
Mechanical properties of cubic boron nitride and diamond at dynamical pressure and temperature
Srihari M. Kastuar, Zhong-Li Liu, Sina Najmaei +1
We report the mechanical properties of cubic boron nitride (c-BN) and diamond under the combined impact of dynamical pressure and temperature, calculated using ab initio molecular…
-factor engineering with InAsSb alloys toward zero band gap limit
Yuxuan Jiang, Maksim Ermolaev, Seongphill Moon +7
Band gap is known as an effective parameter for tuning the Lande -factor in semiconductors and can be manipulated in a wide range through the bowing effect in ternary alloys. In…
Structural, electronic, and magnetic properties of CrTe2
Yuhang Liu, Sohee Kwon, George J. de Coster +2
Two-dimensional chromium ditelluride (CrTe2) is a promising ferromagnetic layered material that exhibits long-range ferromagnetic ordering in the monolayer limit. The formation ene…
Phase Stability of Hexagonal/cubic Boron Nitride Nanocomposites
Abhijit Biswas, Rui Xu, Joyce Christiansen-Salameh +21
Boron nitride (BN) is an exceptional material and among its polymorphs, two-dimensional (2D) hexagonal and three-dimensional (3D) cubic BN (h-BN and c-BN) phases are most common. T…
Non-linear optics at twist interfaces in h-BN/SiC heterostructures
Abhijit Biswas, Rui Xu, Gustavo A. Alvarez +24
Understanding the emergent electronic structure in twisted atomically thin layers has led to the exciting field of twistronics. However, practical applications of such systems are…
Structural evolution of iodine on approach to the monatomic state
Elena Bykova, Iskander G. Batyrev, Maxim Bykov +4
We applied single-crystal X-ray diffraction and Raman spectroscopy in a diamond anvil cell up to 36 GPa and first principles theoretical calculations to study the molecular dissoci…