activity
20172023
most citedQuantifying Confidence in Density Functional Theory Predicted Magnetic Ground States

35 citations · 109 across the 16 of their papers we have counts for

collaborators
Showing physics.chem-phShow all

8 papers · 1 filter

physics.chem-ph20211 cited

Thermodynamics of Lithium Stripping and Limits for Fast Discharge in Lithium Metal Batteries

Victor Venturi, Venkatasubramanian Viswanathan

Lithium metal batteries are seen as a critical piece towards electrifying aviation. During charging, plating of lithium metal, a critical failure mechanism, has been studied and mi…

physics.chem-ph2020

Closed-Loop Design of Proton Donors for Lithium-Mediated Ammonia Synthesis with Interpretable Models and Molecular Machine Learning

Dilip Krishnamurthy, Nikifar Lazouski, Michal L. Gala +2

In this work, we experimentally determined the efficacy of several classes of proton donors for lithium-mediated electrochemical nitrogen reduction in a tetrahydrofuran-based elect…

physics.chem-ph2020

Kinetics of lithium electrodeposition and stripping

Shashank Sripad, Daniel Korff, Steven C. DeCaluwe +1

Electrodeposition and stripping are fundamental electrochemical processes for metals and have gained importance in rechargeable Li-ion batteries due to lithium metal electrodes. Th…

physics.chem-ph2020

Marcus-Hush-Chidsey Kinetics at Electrode-Electrolyte Interfaces

Rachel Kurchin, Venkatasubramanian Viswanathan

Electrochemical kinetics at electrode-electrolyte interfaces limit performance of devices including fuel cells and batteries. While the importance of moving beyond Butler-Volmer ki…

physics.chem-ph2019

Descriptors for Electrolyte-Renormalized Oxidative Stability of Solvents in Lithium-ion Batteries

Vikram Pande, Venkatasubramanian Viswanathan

Electrolyte stability against oxidation is one of the important factors limiting the development of high energy density batteries. HOMO level of solvent molecules has been successf…

physics.chem-ph2019

Benchmarking conductivity predictions of the Advanced Electrolyte Model (AEM) for aqueous systems

Adarsh Dave, Kevin L. Gering, Jared M. Mitchell +2

High-concentration aqueous electrolytes have shown promise as candidates for a safer, lower-cost battery system. Ionic conductivity is a key property required in high performing el…