538 citations · 782 across the 10 of their papers we have counts for
10 papers
Raman spectroscopy study of pressure-induced phase transitions in single crystal CuInP2S6
R. Rao, B. S. Conner, J. Jiang +2
Two dimensional ferroic materials exhibit a variety of functional properties that can be tuned by temperature and pressure. CuInP2S6 is a layered material that is ferrielectric at…
Investigating strain between phase-segregated domains in Cu-deficient CuInP2S6
Rahul Rao, Ryan Selhorst, Jie Jiang +6
CuInP2S6 (CIPS) is an emerging layered ferroelectric material with a TC above room temperature. When synthesized with Cu deficiencies (i.e., Cu1-xIn1+x/3P2S6), the material segrega…
Fano plasmonics goes nonlinear
Maxim Sukharev, Elena Drobnyh, Ruth Pachter
We investigate the process of the second harmonic generation by plasmonic nano-antennas that exhibit Fano-like resonances. A rigorous fully vectorial Maxwell-hydrodynamics approach…
Multi-modal Spectroscopic Study of Surface Termination Evolution in Cr2TiC2Tx MXene
James L. Hart, Kanit Hantanasirisakul, Andrew C. Lang +6
Control of surface functionalization of MXenes holds great potential, and in particular, may lead to tuning of magnetic and electronic order in the recently reported magnetic Cr2Ti…
The Joint Automated Repository for Various Integrated Simulations (JARVIS) for data-driven materials design
Kamal Choudhary, Kevin F. Garrity, Andrew C. E. Reid +25
The Joint Automated Repository for Various Integrated Simulations (JARVIS) is an integrated infrastructure to accelerate materials discovery and design using density functional the…
Computational Search for Magnetic and Non-magnetic 2D Topological Materials using Unified Spin-orbit Spillage Screening
Kamal Choudhary, Kevin F. Garrity, Jie Jiang +2
Two-dimensional topological materials (TMs) have a variety of properties that make them attractive for applications including spintronics and quantum computation. However, there ar…
Accelerated Discovery of Efficient Solar-cell Materials using Quantum and Machine-learning Methods
Kamal Choudhary, Marnik Bercx, Jie Jiang +3
Solar-energy plays an important role in solving serious environmental problems and meeting high-energy demand. However, the lack of suitable materials hinders further progress of t…
Harmonic generation by metal nanostructures optically coupled to 2D transition metal dichalcogenide
Elena Drobnyh, Ruth Pachter, Maxim Sukharev
Rigorous electrodynamical simulations based on the nonlinear Drude model are performed to investigate the influence of strong coupling on high harmonic generation by periodic metal…
Effects of exciton-plasmon strong coupling on third harmonic generation of WS2 monolayer at periodic plasmonic interfaces
Maxim Sukharev, Ruth Pachter
We study theoretically optical response of WS2 monolayer located near periodic metal nanostructured arrays in two and three dimensions. The emphasis of simulations is on the strong…
Linear and nonlinear optics of hybrid plasmon-exciton nanomaterials in the presence of overlapping resonances
Maxim Sukharev, Paul N. Day, Ruth Pachter
We consider a hybrid plasmon-exciton system comprised of a resonant molecular subsystem and three Au wires supporting a dipole mode which can be coupled to a dark mode in controlla…