Topics¶

Browse digests by research theme.

Solid Electrolytes¶

Halide, sulfide, oxide, and polymer solid electrolytes — ionic conductivity, stability, processing.

• 2026 Roadmap on Next-Generation Solid Electrolytes

ML Interatomic Potentials¶

Universal MLIPs, fine-tuning strategies, uncertainty quantification, new architectures.

• Bias in Universal MLIPs and its Effects on Fine-Tuning
• PFP v8: Universal MLIP with r2SCAN Functional
• Predicting Crystal Structures in \(\ce{Li3YCl6-xBrx}\) Using Fine-Tuned CHGNet
• Latent Space Design of Interatomic Potentials

Polymer Electrolytes¶

Polymer electrolyte design, ion transport mechanisms, high-throughput screening.

• Discovery of Polymer Electrolytes with Bayesian Optimization

Phase Field / Dendrites¶

Phase field modeling, dendrite growth, surrogate models for PDE solvers.

• Adaptive Uncertainty-Guided Surrogates for Phase Field Dendritic Solidification

Defects & Interfaces¶

Defect chemistry, grain boundaries, electrolyte/electrode interfaces.

• Scaling Autoregressive Models for Lattice Thermodynamics