A toolkit for querying data in OQMD.
☆23Jan 2, 2022Updated 4 years ago
Alternatives and similar repositories for qmpy_rester
Users that are interested in qmpy_rester are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Python API wrapping the AFLUX API language for AFLOW library.☆30May 6, 2021Updated 5 years ago
- A suite of computational materials science tools.☆146Jun 29, 2026Updated 4 months ago
- ☆20Oct 18, 2022Updated 4 years ago
- ☆12Jan 16, 2024Updated 2 years ago
- Batch calculation for the Materials Properties Prediction project☆16Sep 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.
- image-based generative model for inverse design of solid state materials☆44Feb 18, 2022Updated 4 years ago
- ☆16Sep 30, 2026Updated last month
- A repo of examples for the matminer (https://github.com/hackingmaterials/matminer) code☆128Jun 7, 2021Updated 5 years ago
- MODNet: a framework for machine learning materials properties☆114May 2, 2025Updated last year
- Twin-deep neural network for semi-supervised learning of materials properties☆12Feb 1, 2023Updated 3 years ago
- Software for evaluating pareto-optimal synthesis pathways☆23Jun 10, 2024Updated 2 years ago
- Comparative Analysis of Machine Learning Approaches on the Prediction of the Electronic Properties of Perovskite: A Case Study of the ABX…☆29Jan 11, 2022Updated 4 years ago
- ⚗️ matador is an aggregator, manipulator and runner of first-principles calculations, written with a bent towards battery 🔋 electrode ma…☆35Updated this week
- This module uses Crystal Structure Prototype Database (CSPD) to generate a list of crystal structures for the system defined by user.☆19Feb 7, 2019Updated 7 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.
- Solid-state synthesis science analyzer. Thermo, features, ML, and more.☆27Sep 1, 2022Updated 4 years ago
- vasp calculation flow☆22Sep 24, 2023Updated 3 years ago
- ☆34Feb 17, 2022Updated 4 years ago
- The Bond valence site energy calculator☆28Aug 21, 2025Updated last year
- This is the source code of CubicGAN generating cubic crystal structures using improved WGAN.☆11Jun 6, 2022Updated 4 years ago
- A set of tools used for setup, analysis and post-processing of Density Functional Theory (DFT) calculations performed with the VASP packa…☆17Feb 5, 2018Updated 8 years ago
- Machine learning model for crystal lattice constant prediction☆14Mar 17, 2021Updated 5 years ago
- IANN (InterAtomic Neural Network) framework is an equivariant interatomic neural network potential framework package☆18Sep 23, 2026Updated last month
- Solve the N-D time-independent Schrödinger equation for a single particle.☆10Nov 24, 2019Updated 6 years ago
- 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.
- Restructure single parabolic band(RSPB) model used for thermoelectricity☆11Jul 25, 2025Updated last year
- A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.☆35Aug 19, 2022Updated 4 years ago
- Automatic generation of crystal structure descriptions.☆142Updated this week
- Original implementation of CSPML☆29Dec 22, 2024Updated last year
- This repo implements a web application utilizing a deep neural network to predict the formation energies and stability of garnet crystals…☆33May 1, 2023Updated 3 years ago
- Common NLP (text mining) tools for materials science and chemistry, for groups at Lawrence Berkeley National Lab (LBNL) and beyond.☆23Jul 8, 2022Updated 4 years ago
- Crystal graph convolutional neural networks for predicting material properties.☆33Nov 9, 2022Updated 3 years ago
- Curated list of known efforts in collecting and/or curating of chemical/materials data☆24Dec 8, 2020Updated 5 years ago
- Data-driven risk-conscious thermoelectric materials discovery☆18Jul 31, 2026Updated 3 months ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- ☆15Aug 13, 2021Updated 5 years ago
- An introduction to DFT.☆15May 17, 2024Updated 2 years ago
- A python library for handling ionic compounds☆11Feb 13, 2026Updated 8 months ago
- A python library for accessing the ICSD API Client. Under no affiliation with Fitz-Karlsruhe, please see https://icsd.fiz-karlsruhe.de/in…☆22Oct 26, 2026Updated last week
- The Open Knowledgebase of Interatomic Models (OpenKIM) aims to be an online resource for standardized testing, long-term warehousing and …☆41Mar 6, 2026Updated 8 months ago
- Querying databases, Organizing and Plotting Data: Query Pymatgen for properties like Young's modulus and melting temperature Organize dat…☆17Aug 18, 2021Updated 5 years ago
- Python script to plot periodic trends as a heat map over the periodic table of elements☆118Nov 7, 2025Updated last year