Janine George

20PUBLICATIONS
199CO-AUTHORS
Computational chemistryProgramming languagesModelling and simulationWastewater treatment processesFormal methods for software
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Journal

Publications (20)

|Nov 13, 2025
A foundation model for atomistic materials chemistry.

Ilyes Batatia, Philipp Benner, Yuan Chiang

|Oct 20, 2025
A python workflow definition for computational materials design.

Jan Janssen, Janine George, Julian Geiger

|Oct 06, 2025
32 examples of LLM applications in materials science and chemistry: towards automation, assistants, agents, and accelerated scientific discovery.

Yoel Zimmermann, Adib Bazgir, Alexander Al-Feghali

|Sep 18, 2025
Mechanochemically Synthesized Covalent Organic Framework Effectively Captures PFAS Contaminants.

Maroof Arshadul Hoque, Thomas Sommerfeld, Jan Lisec

|Aug 18, 2025
An automated framework for exploring and learning potential-energy surfaces.

Yuanbin Liu, Joe D Morrow, Christina Ertural

|Jul 04, 2025
Atomate2: modular workflows for materials science.

Alex M Ganose, Hrushikesh Sahasrabuddhe, Mark Asta

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Frequent Collaborators

7 joint publications

Aakash Naik

6 joint publications

Volker L Deringer

4 joint publications

Richard Dronskowski

4 joint publications

Gian-Marco Rignanese