An attention-based deep neural network for thermoelectric transport properties
☆18Apr 5, 2023Updated 3 years ago
Alternatives and similar repositories for CraTENet
Users that are interested in CraTENet are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆14May 26, 2021Updated 5 years ago
- Predict materials properties using only the composition information!☆17Jun 4, 2025Updated last year
- ☆15Apr 8, 2023Updated 3 years ago
- Distributed representations of atoms, inspired by the Skip-gram model☆28Jul 16, 2023Updated 2 years ago
- AtomGPT.org API Usage Examples Paper: https://arxiv.org/abs/2512.11935 Docs: https://atomgptlab.github.io/agapi/☆33May 10, 2026Updated last month
- 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.
- Chemically Directed Atom Swap Hopping -- Crystal structure prediction by swapping atoms in unfavourable chemical environments☆22Apr 19, 2023Updated 3 years ago
- CME-ChatGPT Material Explorer☆23Jul 10, 2025Updated 11 months ago
- Software for evaluating pareto-optimal synthesis pathways☆24Jun 10, 2024Updated 2 years ago
- BoltzTraP_Tools is an interface written using Python 2 language. It allows to parse and plot BoltzTraP output DATA☆19Mar 7, 2021Updated 5 years ago
- Data-driven risk-conscious thermoelectric materials discovery☆17Nov 12, 2025Updated 7 months ago
- 《能源环境材料计算模拟方法》学习笔记,包括linux基础命令、pbs作业管理系统、vasp、materials studio等。☆24Updated this week
- The Element Movers Distance for chemical composition similarity☆38Mar 21, 2025Updated last year
- ThermoElectric is a computational framework that computes electron transport coefficients.☆24Sep 23, 2024Updated last year
- Make periodic table map plots and pettifor-style trend plots.☆28Apr 9, 2018Updated 8 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.
- We present the virtual node graph neural network (VGNN) to address the challenges in phonon prediction.☆25Oct 28, 2024Updated last year
- Linux系统与网络管理课程作业收集 http://sec.cuc.edu.cn☆10Mar 14, 2022Updated 4 years ago
- Heat-conductivity benchmark test for foundational machine-learning potentials☆30Jan 29, 2026Updated 4 months ago
- Code for Explainable Synthesizability Prediction of Inorganic Crystal Polymorphs using Large Language Models☆12Feb 19, 2025Updated last year
- A Python package for adding uncertainties to neural network models of chemical systems.☆27Jul 5, 2022Updated 3 years ago
- bands4vasp -- post processing package for the analysis of unfolded eigenstates in VASP, and much more: band structures, 2D and 3D Fermi s…☆15May 18, 2026Updated 3 weeks ago
- Restructure single parabolic band(RSPB) model used for thermoelectricity☆11Jul 25, 2025Updated 10 months ago
- ☆13Dec 14, 2024Updated last year
- ☆15Jul 24, 2024Updated last year
- GPUs on demand by Runpod - Special Offer Available • AdRun AI, ML, and HPC workloads on powerful cloud GPUs—without limits or wasted spend. Deploy GPUs in under a minute and pay by the second.
- A curated list of awesome resources on using machine learning and data science for discovery of physical laws☆40Jun 22, 2020Updated 5 years ago
- Python package for calculating thermodynamic potentials from first-principles calculations☆14Dec 22, 2023Updated 2 years ago
- Semiemperical quasiharmonic thermal elasticity☆22Dec 10, 2025Updated 6 months ago
- DiffSyn: A Generative Diffusion Approach to Materials Synthesis Planning (Nature Computational Science, 2026)☆42Feb 10, 2026Updated 4 months ago
- Electron Transport (ELECTRA), open source code from the "GENESIS" project☆13Dec 3, 2025Updated 6 months ago
- ☆25Aug 21, 2025Updated 9 months ago
- The latest stable release for the crystal structure prediction code FUSE☆13Oct 28, 2025Updated 7 months ago
- Evaluation of universal machine learning force-fields https://doi.org/10.1021/acsmaterialslett.5c00093☆10Jul 8, 2025Updated 11 months ago
- ☆40Nov 16, 2023Updated 2 years 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.
- ☆14Jul 13, 2025Updated 11 months ago
- RAGSkeleton: A foundational, modular framework for building customizable Retrieval-Augmented Generation (RAG) systems across any domain.☆14Jun 24, 2025Updated 11 months ago
- Collective atomic modulation analysis with irreducible space-group representation☆18Jun 8, 2026Updated last week
- CrysXPP: An Explainable Property Predictor for Crystalline Materials (NPJ Computational Materials - 2022)☆21Jul 4, 2023Updated 2 years ago
- Accelerated Design of Layered Materials with Bayesian Optimization☆20Dec 10, 2018Updated 7 years ago
- Curated list of known efforts in collecting and/or curating of chemical/materials data☆24Dec 8, 2020Updated 5 years ago
- compare training duration of CNN with CPU (i7 8550U) vs GPU (mx150) with CUDA depending on batch size☆12Mar 24, 2018Updated 8 years ago