Yeonghun1675 / L2M3View external linksLinks
Large Language Models Material Miner
☆51Feb 18, 2025Updated 11 months ago
Alternatives and similar repositories for L2M3
Users that are interested in L2M3 are comparing it to the libraries listed below
Sorting:
- JAX implementation of the NequIP neural network interatomic potential☆14Jul 23, 2025Updated 6 months ago
- A molecular simulation package integrating MLFFs in MOFs for DAC☆42Oct 17, 2025Updated 3 months ago
- Wyckoff Transformer: Generation of Symmetric Crystals [ICML 2025]☆25Jan 20, 2026Updated 3 weeks ago
- Code for Explainable Synthesizability Prediction of Inorganic Crystal Polymorphs using Large Language Models☆12Feb 19, 2025Updated 11 months ago
- ☆18Feb 1, 2023Updated 3 years ago
- A Benchmarking Framework for Crystal GNNs☆20Jan 3, 2024Updated 2 years ago
- Reproduction of CGCNN for predicting material properties☆24Feb 2, 2026Updated last week
- Design of metal-organic frameworks using deep dreaming approaches☆19Dec 2, 2025Updated 2 months ago
- This repository contains neccessary code to train AnisoNet, an equivariant graph neural network for predicting dielectric tensors of crys…☆13Aug 26, 2025Updated 5 months ago
- Universal Transfer Learning in Porous Materials, including MOFs.☆115Jun 20, 2024Updated last year
- Equitrain: A Unified Framework for Training and Fine-tuning Machine Learning Interatomic Potentials☆11Jan 28, 2026Updated 2 weeks ago
- Python interface for the zeo++ package☆17Aug 15, 2025Updated 5 months ago
- Molecular Crystal Representation from Transformer☆15Dec 19, 2024Updated last year
- The latest stable release for the crystal structure prediction code FUSE☆13Oct 28, 2025Updated 3 months ago
- Predict and Inverse design for metal-organic framework with large-language models (llms)☆109May 15, 2025Updated 8 months ago
- Poreblazer is a set of Fortran 90 tools for structural characterization of porous materials.☆13Feb 28, 2018Updated 7 years ago
- Local Environment-based Atomic Features☆13Dec 19, 2024Updated last year
- A text-guided diffusion model for crystal structure generation☆74May 30, 2025Updated 8 months ago
- Code and Data for "Large Language Models for Inorganic Synthesis Prediction"☆33Sep 4, 2024Updated last year
- ☆20Nov 19, 2025Updated 2 months ago
- Python library for the construction of porous materials using topology and building blocks.☆84May 28, 2025Updated 8 months ago
- Multi-modal conditioning diffusion model for MOFs generation☆42Nov 19, 2025Updated 2 months ago
- CoRE-MOF as a Python package☆22Nov 21, 2024Updated last year
- A Transfer Learning Study of Gas Adsorption in Metal-Organic Frameworks☆14Jul 15, 2020Updated 5 years ago
- ☆24Nov 1, 2024Updated last year
- ☆31Jul 8, 2025Updated 7 months ago
- [npj Comp. Mat.] Higher-order equivariant neural networks for charge density prediction in materials☆71Feb 21, 2025Updated 11 months ago
- Structure Prototype Analysis Package can analyze symmetry and compare similarity of a large number of atomic structures.☆23Sep 9, 2022Updated 3 years ago
- Agentic framework combining the power of LLMs with domain-specific tools for materials science, enabling property extraction, simulations…☆11May 1, 2025Updated 9 months ago
- Clean, Uniform and Refined with Automatic Tracking from Experimental Database (CURATED) COFs☆46Oct 22, 2023Updated 2 years ago
- A collection of tools I created related to the molecular simulations package RASPA.☆12Dec 4, 2023Updated 2 years ago
- CrystalGRW: Generative Modeling of Crystal Structures with Targeted Properties via Geodesic Random Walks☆13Sep 22, 2025Updated 4 months ago
- ☆29Sep 13, 2024Updated last year
- This repository contains a collection of resources and papers on GNN Models on Crystal Solid State Materials☆113Oct 24, 2025Updated 3 months ago
- Wyckoff Inorganic Crystal Generator Framework☆28Mar 7, 2025Updated 11 months ago
- ☆16May 31, 2024Updated last year
- Compilation of code employed in the construction and analysis of the MOSAEC database.☆16Feb 6, 2025Updated last year
- Licensed under Academic Non-Commercial Share-Alike License☆17Sep 3, 2025Updated 5 months ago
- ☆11Sep 1, 2025Updated 5 months ago