Resources
Teaching Materials & Interactive Tools for Research and Education
Teaching Materials
Reading & Writing Papers
Strategies for reading papers and writing manuscripts in the LLM era.
Atomic Simulation in Python
DFT, MD, and ML potentials using Python and ASE.
Atomic Visualization with Blender
Publication-quality 3D renderings with Blender and AI prompting.
Research Figures in Python
Scientific figures with Matplotlib and Seaborn.
Free Energy in Catalysis
ZPE, entropy, CHE model, and DFT free energy calculations.
Software & Tools
Talk&Listen
AI voice assistant with text-to-speech and speech-to-text capabilities.
Oxidation State Estimator
Estimate oxidation states from Bader charge analysis.
Nanocluster Digital Universe
Explore nanocluster structures via an interactive periodic table.