☆28Aug 20, 2025Updated 11 months ago
Alternatives and similar repositories for lematerial-hasher
Users that are interested in lematerial-hasher are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Tool to fetch, parse, and standardize materials data from various databases for LeMaterial.☆19Jun 8, 2026Updated 2 months ago
- ☆12Jul 20, 2026Updated 3 weeks ago
- Benchmarking foundation Machine Learning Potentials with Lattice Thermal Conductivity from Anharmonic Phonons☆15Oct 30, 2024Updated last year
- Heat-conductivity benchmark test for foundational machine-learning potentials☆30Jun 28, 2026Updated last month
- Phonons from ML force fields☆24Mar 22, 2026Updated 4 months ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- Computing representations for atomistic machine learning☆82Jul 22, 2026Updated 3 weeks ago
- Python Workflow Definition - workflow interoperability for aiida, jobflow and pyiron☆19Updated this week
- [TMLR 2024 J2C Certification] Generalizing Denoising to Non-Equilibrium Structures Improves Equivariant Force Fields☆43Feb 11, 2025Updated last year
- URL links to phonondb data☆41May 20, 2026Updated 2 months ago
- Adds Orb Model functionality to LAMMPS via Python wrapping☆15Apr 1, 2025Updated last year
- This repository contains neccessary code to train AnisoNet, an equivariant graph neural network for predicting dielectric tensors of crys…☆14Feb 20, 2026Updated 5 months ago
- Equivariant machine learning model for predicting self-consistent Hubbard parameters☆18Apr 13, 2026Updated 4 months ago
- Library for Crystal Symmetry in Rust☆76Updated this week
- GRACE models and gracemaker (as implemented in TensorPotential package)☆103Jul 13, 2026Updated last month
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Pymatgen Core☆24Updated this week
- MatTen: Equivariant Graph Neural Nets for Tensorial Properties of Materials☆44May 28, 2026Updated 2 months ago
- An open-source multi-modal toolbox for extracting structured synthesis procedures and performance data from materials science literature …☆43Aug 5, 2026Updated last week
- jobflow-remote is a Python package to run jobflow workflows on remote resources.☆40Updated this week
- Tutorial exercises for the OPTIMADE API☆17Sep 27, 2023Updated 2 years ago
- [EMNLP '25] A web app and Python API for multi-modal RAG framework to ground LLMs on high-fidelity materials informatics. An agentic mate…☆100Nov 11, 2025Updated 9 months ago
- Crystal Host-Guided Generation☆19Apr 24, 2025Updated last year
- ⚛ download and manipulate atomistic datasets☆49Nov 25, 2025Updated 8 months ago
- Equitrain: A Unified Framework for Training and Fine-tuning Machine Learning Interatomic Potentials☆29Aug 6, 2026Updated last week
- End-to-end encrypted email - Proton Mail • AdSpecial offer: 40% Off Yearly / 80% Off First Month. All Proton services are open source and independently audited for security.
- ☆14Feb 11, 2025Updated last year
- Helpers for working with pymatgen structure graphs.☆12Feb 4, 2025Updated last year
- Collective atomic modulation analysis with irreducible space-group representation☆18Updated this week
- Generative framework for crystal structure prediction and de novo generation of inorganic crystals.☆54Jun 30, 2026Updated last month
- Alchemical machine learning interatomic potentials☆36Nov 8, 2024Updated last year
- [ICML'26] Phonon fine-tuning (PFT) and [NeurIPS'25 AI4Mat] Nequix: Training a foundation model for materials on a budget☆75Apr 5, 2026Updated 4 months ago
- Data Science for Materials - Collection of Open Educational Resources☆17Jun 18, 2025Updated last year
- A python library for accessing the ICSD API Client. Under no affiliation with Fitz-Karlsruhe, please see https://icsd.fiz-karlsruhe.de/in…☆22Jul 27, 2026Updated 2 weeks ago
- This repo contains code and data of our contribution to the 2024 LLM Hackathon, materials' property prediction from textual descriptions …☆12May 9, 2024Updated 2 years ago
- Bare Metal GPUs on DigitalOcean Gradient AI • AdPurpose-built for serious AI teams training foundational models, running large-scale inference, and pushing the boundaries of what's possible.
- DistMLIP: A Distributed Inference Library for Fast, Large Scale Atomistic Simulation☆98Sep 20, 2025Updated 10 months ago
- ☆20May 7, 2024Updated 2 years ago
- A python library for calculating materials properties from the PES☆149Updated this week
- Generative materials benchmarking metrics, inspired by guacamol and CDVAE.☆41Jun 1, 2024Updated 2 years ago
- Jupyter Book source files for 2022 MSD summer research internship.☆14Jul 10, 2023Updated 3 years ago
- Generate symmetrized force constants☆29Updated this week
- ML benchmarking and pipeling framework☆15Oct 28, 2025Updated 9 months ago