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AtomGPTLab

non-profit
https://github.com/atomgptlab
atomgptlab
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Kamal Choudhary's profile pictureCharles Campbell's profile picture

knc6 
authored 8 papers 3 months ago

The JARVIS Infrastructure is All You Need for Materials Design

Paper • 2503.04133 • Published Mar 6, 2025

Unified Graph Neural Network Force-field for the Periodic Table

Paper • 2209.05554 • Published Sep 12, 2022

ChemNLP: A Natural Language Processing based Library for Materials Chemistry Text Data

Paper • 2209.08203 • Published Sep 17, 2022 • 1

Fast and Accurate Prediction of Material Properties with Three-Body Tight-Binding Model for the Periodic Table

Paper • 2112.11585 • Published Dec 22, 2021

DiffractGPT: Atomic Structure Determination from X-ray Diffraction Patterns using Generative Pre-trained Transformer

Paper • 2508.08349 • Published Aug 11, 2025 • 1

Designing High-Tc Superconductors with BCS-inspired Screening, Density Functional Theory and Deep-learning

Paper • 2205.00060 • Published Apr 29, 2022

A Deep-learning Model for Fast Prediction of Vacancy Formation in Diverse Materials

Paper • 2205.08366 • Published May 17, 2022

JARVIS-Leaderboard: A Large Scale Benchmark of Materials Design Methods

Paper • 2306.11688 • Published Jun 20, 2023
knc6 
authored a paper over 1 year ago

AtomGPT: Atomistic Generative Pre-trained Transformer for Forward and Inverse Materials Design

Paper • 2405.03680 • Published May 6, 2024 • 1
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