4 papers
Many-body benchmarking of DFT local-registry energetics in bilayer InSe
Jeonghwan Ahn, Abdulgani Annaberdiyev, Jovan Nelson +2
Density functional theory (DFT) is widely used to model twisted bilayers, but the accuracy of the local stacking energetics underlying such models remains uncertain. Here, we bench…
The Role of Defect Geometry in Localized Emission from Monolayer Tungsten Dichalcogenides
S. Carin Gavin, Moumita Kar, Jianguo Wen +10
Understanding the mechanism of single photon emission (SPE) in two-dimensional (2D) material is an unsolved problem important for quantum optical materials and the development of q…
Modifying the Optical Emission of Vanadyl Phthalocyanine via Molecular Self-Assembly on van der Waals Materials
S. Carin Gavin, William Koll, Moumita Kar +12
Vanadyl phthalocyanine (VOPc) is a promising organic molecule for applications in quantum information because of its thermal stability, efficient processing, and potential as a spi…
High Temperature Quantum Emission from Covalently Functionalized van der Waals Heterostructures
S. Carin Gavin, Hsun-Jen Chuang, Anushka Dasgupta +10
Two-dimensional (2D) transition metal dichalcogenides (TMDs) are attractive nanomaterials for quantum information applications due to single photon emission (SPE) from atomic defec…