A07 - Solid-Electrolyte Modeling II

Tuesday, 15 October 2019: 13:40-15:40
Room 221 (The Hilton Atlanta)
Chairs:
Donald J Siegel and Xin Li
13:40
Investigating All-Solid-State Battery Cell Inhomogeneities and Their Coupling to Interfacial Phenomena By Continuum Modelling and Simulation
K. Becker-Steinberger (Helmholtz Institute Ulm (HIU), German Aerospace Center (DLR)), A. Neumann (Karlsruhe Institute of Technology (KIT), Helmholtz Institute Ulm (HIU)), S. Hein (Helmholtz Institute Ulm (HIU), German Aerospace Center (DLR)), K. Urban (Institute of Numerical Mathematics, University of Ulm), and A. Latz (German Aerospace Center (DLR), Helmholtz Institute Ulm (HIU))
14:00
14:20
Predicting Polymer Flammability Using Machine Learning Methods
M. Shelton, S. Venkatram, and R. Ramprasad (Georgia Institute of Technology)
14:40
Comparison of Correlated Li+ Diffusion from Molecular Dynamics of Promising Solid Electrolytes
N. Adelstein, V. Y. Z. Wei, Z. Mehmedović, A. Grieder, N. Leclerc (San Francisco State University), A. Musaelian (University of Oklahoma), L. Kahle, N. Marzari (École polytechnique fédérale de Lausanne), B. Kozinsky (Harvard University), T. J. Udovic (National Institute of Standards and Technology), P. Mehta (University of Notre Dame), V. Stavila (Sandia National Laboratory), O. Borodin (US Army Research Laboratory), S. A. Akhade, P. Shea, K. Kweon, J. B. Varley, and B. C. Wood (Lawrence Livermore National Laboratory)
15:00
Atomic-Scale Simulations of Grain Boundary Mechanical Properties in the Solid Electrolyte Li7La3Zr2O12
S. Yu (Korea Institute of Science and Technology, University of Michigan), H. Park (University of Michigan), and D. J. Siegel (University of Michigan, Ann Arbor)
15:20
Electrochemical Stability Window of Polymeric Electrolytes
L. Chen, S. Venkatram, C. Kim, R. Batra, A. Chandrasekaran, and R. Ramprasad (Georgia Institute of Technology)