Regensburg 2025 – scientific programme

Parts | Days | Selection | Search | Updates | Downloads | Help

MM: Fachverband Metall- und Materialphysik

MM 8: Materials for the Storage and Conversion of Energy (joint session MM/KFM)

Monday, March 17, 2025, 17:15–18:30, H22

Lithium-based Materials

	17:15	MM 8.1	Lithium diffusion pathways in modern solid state Li conductors — •Mykhaylo Monchak, Volodymyr Baran, Stefan Strangmüller, and Anatoliy Senyshyn
	17:30	MM 8.2	"Effortless Embedding": Non-Parametric Solid-State Embedding for NMR Computations using All-Electron DFT — •Federico Civaia, Simone S. Köcher, Karsten Reuter, and Christoph Scheurer
	17:45	MM 8.3	Insights into Li-ion battery cathode redox chemistry via charge transfer multiplet simulations of LiNi1/3Mn1/3Co1/3O2 — •Ruiwen Xie, Maximilian Mellin, Wolfram Jaegermann, Jan. P Hofmann, and Hongbin Zhang
	18:00	MM 8.4	Modelling LLZO Grain Boundaries with Amorphous Domains by Adaptively Trained Machine-Learning Interatomic Potentials — •Yuandong Wang, Yute Chan, Hao Wan, Kyeonghyeon Nam, Karsten Reuter, and Christoph Scheurer
	18:15	MM 8.5	Early Stage of Li Cluster Nucleation at the Li Anode-Solid Electrolyte Interface in Solid-State Batteries — •Yun An, Taiping Hu, Quanquan Pang, and Shenzhen Xu