Convexification of Charge Equilibrium within the Dendrites of Rechargeable Batteries
Asghar Aryanfar, Dimitri M. Saad, William A. Goddard III

TL;DR
This paper introduces a computationally efficient method to determine charge equilibrium in microstructures of rechargeable batteries, addressing the non-convex stochastic nature of charge distribution to improve modeling and optimization.
Contribution
A novel, less computationally intensive method for charge allocation in microstructures, enabling better optimization in non-convex, stochastic environments.
Findings
The method closely matches traditional approaches in cost function and charge span.
It significantly reduces computational costs compared to conventional methods.
Applicable for optimizing charge distribution in complex microstructures.
Abstract
The amorphous propagation of microstructures during the electrochemical charging of a battery is the main reason for the capacity decay and short circuit. The charge distribution across the micro-structure is the result of both local and global equilibrium and is non-convex problem merely due to stochastic placement of the atoms. As such, obtaining the charge equilibrium (QEq) is a critical factor, since the amount of charge determines the success rate of the bond formation for the ionic species approaching the microstructure and consequently the ultimate morphology of the electrochemical deposits. Herein we develop a computationally-affordable method for determining the charge allocation within such microstructures. The cost function and the span of the charge distribution correlates very closely with the trivial method as well as a conventional method, albeit having significantly less…
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Taxonomy
TopicsAdvancements in Battery Materials · Advanced Battery Materials and Technologies · Advanced Battery Technologies Research
