Name: Katharina Ueltzen
Type: User
Company: Federal Institute for Materials Research and Testing
Bio: Doctoral student in the group of Prof. Janine George at the Federal Institute for Materials Research and Testing
Location: Berlin, Germany
Katharina Ueltzen's Projects
This repo contains code and data of our contribution to the 2024 LLM Hackathon, materials' property prediction from textual descriptions of structures and their bonding properties.
Package to automatically analyze Lobster runs
A neural network model for materials property prediction based on coordination environments
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.