activity
20062022
most citedGrand canonical electronic density-functional theory: algorithms and applications to electrochemistry

414 citations · 1.1k across the 9 of their papers we have counts for

collaborators

16 papers

physics.chem-ph202229 cited

Interfacial water asymmetry at ideal electrochemical interfaces

Abhishek Shandilya, Kathleen Schwarz, Ravishankar Sundararaman

Controlling electrochemical reactivity requires a detailed understanding of the charging behavior and thermodynamics of the electrochemical interface. Experiments can independently…

cond-mat.mtrl-sci2019

Spin-phonon relaxation from a universal \emph{ab initio} density-matrix approach

Junqing Xu, Adela Habib, Sushant Kumar +3

Designing new quantum materials with long-lived electron spin states urgently requires a general theoretical formalism and computational technique to reliably predict intrinsic spi…

cond-mat.mtrl-sci2019

Substrate effects on charged defects in two-dimensional materials

Dan Wang, Ravishankar Sundararaman

Two-dimensional (2D) materials are strongly affected by the dielectric environment including substrates, making it an important factor in designing materials for quantum and electr…

cond-mat.mes-hall2018

Dynamics and Spin-Valley Locking Effects in Monolayer Transition Metal Dichalcogenides

Christopher J. Ciccarino, Thomas Christensen, Ravishankar Sundararaman +1

Transition metal dichalcogenides have been the primary materials of interest in the field of valleytronics for their potential in information storage, yet the limiting factor has b…

physics.app-ph2018

Plasmonics in Argentene

Ravishankar Sundararaman, Thomas Christensen, Yuan Ping +4

Two-dimensional materials exhibit a fascinating range of electronic and photonic properties vital for nanophotonics, quantum optics and emerging quantum information technologies. M…

cond-mat.mes-hall2018

Electron mobility in graphene without invoking the Dirac equation

Chaitanya K. Ullal, Jian Shi, Ravishankar Sundararaman

The Dirac point and linear band structure in Graphene bestow it with remarkable electronic and optical properties, a subject of intense ongoing research. Explanations of high elect…