Publications

3550 results for Materials Discovery

Accelerating Material Discovery for Metal Organic Frameworks using Large Language Models
- - Sultan Alrowili
  - Mathan Kumar Eswaran
  - et al.
- 2025
- NeurIPS 2025
A Large Multimodal Molecular Representation Encoder-Decoder Foundation Model for Chemistry
- - Victor Yukio Shirasuna
  - Emilio Ashton Vital Brazil
  - et al.
- 2025
- NeurIPS 2025
Capturing Long-Range Intramolecular Interactions with TDiMS for Interpretable Property Prediction
- - Lisa Hamada
  - Akihiro Kishimoto
  - et al.
- 2025
- NeurIPS 2025
Unclonable fluorescent tags produced on bioplastics by in-situ electron beam irradiation
- - S. Calderon V
  - L.F. Ballesteros
  - et al.
- 2025
- Mater. Today Nano
Leveraging Large Language Models for Suitability Assessment of Electrolytes for Rechargeable Batteries
- - Sina Asuka Klampt
  - Seiji Takeda
  - et al.
- 2025
- MRS Fall Meeting 2025
AI for Advanced Materials in Integration and Packaging
- - Jed Pitera
  - Eric A. Joseph
  - et al.
- 2025
- MRS Fall Meeting 2025
Intercalation-Induced Oxygen Hole Polarons in Layered Transition Metal Oxide Na_2-xMn₃O₇
- - Anirudh Adavi
  - Kayahan Saritas
  - et al.
- 2025
- MRS Fall Meeting 2025
Interpretable Molecular Modeling via LLM Agents with Chain-of-Thought Reasoning
- - Seiji Takeda
  - Indra Priyadarsini S
  - et al.
- 2025
- MRS Fall Meeting 2025
Dynamical mean field theory for real materials on a quantum computer
- - Johannes Selisko
  - Maximilian Amsler
  - et al.
- 2025
- npj Computational Materials
28P L/S Dry Resist Process Flow Co-optimization at Low NA EUV
- - Chun-chia Brown Lu
  - Saumya Gulati
  - et al.
- 2025
- ANS 2025