Neural force field learning toolkit
☆14Dec 22, 2025Updated 4 months ago
Alternatives and similar repositories for nfflr
Users that are interested in nfflr are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Benchmarking foundation Machine Learning Potentials with Lattice Thermal Conductivity from Anharmonic Phonons☆16Oct 30, 2024Updated last year
- ☆13Sep 19, 2023Updated 2 years ago
- ☆10Sep 26, 2025Updated 7 months ago
- DiffSyn: A Generative Diffusion Approach to Materials Synthesis Planning (Nature Computational Science, 2026)☆39Feb 10, 2026Updated 2 months ago
- MATLAB code for laminography reconstruction using SIRT and CGLS☆11Jul 3, 2019Updated 6 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.
- Demonstration notebooks for MIRT.jl☆13Dec 8, 2021Updated 4 years ago
- Julia library for working with sinograms / tomography / Radon transform☆17Mar 30, 2026Updated last month
- Minimal implementation of graph attention student model architecture☆12Apr 15, 2026Updated 2 weeks ago
- ☆22Oct 8, 2025Updated 6 months ago
- Curatable database for experimental and theoretical data on solid materials.☆13Sep 21, 2025Updated 7 months ago
- Uncertainty propagation tool using both Gauss formula and monte carlo method.☆17Mar 13, 2026Updated last month
- Illustrating how to publish battery data☆13May 27, 2025Updated 11 months ago
- Tutorials for Quantum Espresso☆29Aug 18, 2022Updated 3 years ago
- plane wave basis set density functional thoery code☆19Mar 29, 2026Updated last month
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- A JAX-based Differentiable Density Functional Theory Framework for Materials☆48Apr 20, 2026Updated 2 weeks ago
- Python script for regression of multivariable LSTM neural network.☆11Jun 26, 2021Updated 4 years ago
- ApertureDB Python Client☆12Apr 23, 2026Updated last week
- LAMMPS pair styles for NequIP and Allegro deep learning interatomic potentials☆63Mar 11, 2026Updated last month
- SIRF CMake SuperBuild☆19Apr 21, 2026Updated 2 weeks ago
- MCMC-based algorithm for sampling surface reconstructions☆41Mar 1, 2026Updated 2 months ago
- add the influence of external field to REANN model☆27Sep 20, 2024Updated last year
- WEST code☆33Mar 3, 2026Updated 2 months ago
- ☆12Feb 14, 2024Updated 2 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Code to run Spaceman Sam's Tiki DrinkBot☆15Mar 14, 2021Updated 5 years ago
- An overview of literature that discusses the use of machine learning for atomistic simulations☆44Apr 11, 2023Updated 3 years ago
- Our project is based on one of the most important application of machine learning i.e. pattern recognition. Optical character recognition…☆12Jul 30, 2024Updated last year
- Python implementaion of some NIST calculators☆21Jun 15, 2024Updated last year
- Qbox public repository☆39Apr 18, 2026Updated 2 weeks ago
- Static content for GDAL website, refreshed from OSGeo/gdal☆17Apr 7, 2025Updated last year
- ☆18May 20, 2025Updated 11 months ago
- ROS 2 demo workspace showcasing virtual LED-strip HMI with example projects - build, launch, and visualize 3D detections (e.g., human pos…☆16Jul 25, 2025Updated 9 months ago
- Atomistic Line Graph Neural Network https://scholar.google.com/citations?user=9Q-tNnwAAAAJ https://www.youtube.com/@dr_k_choudhary☆317Aug 25, 2025Updated 8 months ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Full-potential Linearized Augmented Plane Wave code FLEUR: All-electron DFT (repo mirror)☆18Updated this week
- Collection of tutorials to use the MACE machine learning force field.☆55Jan 22, 2026Updated 3 months ago
- ☆18Nov 20, 2024Updated last year
- PyTorch implementation of the fast neural style transfer paper 🏎💨🖌️🎨🧠☆29May 17, 2023Updated 2 years ago
- Matterport and Unreal Engine Extension for Omniverse Isaac Sim☆21May 9, 2024Updated last year
- Specification of a common REST API for access to materials databases☆105Apr 24, 2026Updated last week
- Adding hydrogens to molecular models☆61Nov 24, 2025Updated 5 months ago