Python script to plot periodic trends as a heat map over the periodic table of elements
☆117Nov 7, 2025Updated 6 months ago
Alternatives and similar repositories for periodic_trends
Users that are interested in periodic_trends are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Make periodic table map plots and pettifor-style trend plots.☆28Apr 9, 2018Updated 8 years ago
- Band structure unfolding made easy!☆67Apr 28, 2026Updated 3 weeks ago
- A toolkit for visualizations in materials informatics.☆313May 16, 2026Updated last week
- A python library for calculating materials properties from the PES☆142Updated this week
- ☆12Mar 11, 2026Updated 2 months ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- Collective atomic modulation analysis with irreducible space-group representation☆18May 18, 2026Updated last week
- Automatic generation of crystal structure descriptions.☆134May 19, 2026Updated last week
- quacc is a flexible platform for computational materials science and quantum chemistry that is built for the big data era.☆262Updated this week
- Predict materials properties using only the composition information!☆17Jun 4, 2025Updated 11 months ago
- Python package to aid materials design and informatics☆135May 11, 2026Updated 2 weeks ago
- Be a master builder of databases of material properties. Avoid the Kragle.☆66Updated this week
- A Benchmarking Framework for Crystal GNNs☆21Jan 3, 2024Updated 2 years ago
- A collection of tools I created related to the molecular simulations package RASPA.☆12Dec 4, 2023Updated 2 years ago
- MatID is a Python package for identifying and analyzing atomistic systems based on their structure.☆14Aug 26, 2025Updated 9 months 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.
- ASE framework for Monte Carlo simulations with machine learned interatomic potentials☆23May 6, 2026Updated 3 weeks ago
- MODNet: a framework for machine learning materials properties☆109May 2, 2025Updated last year
- Dealing with slabs for first principles calculations of surfaces☆69Sep 17, 2023Updated 2 years ago
- MatTen: Equivariant Graph Neural Nets for Tensorial Properties of Materials☆43Mar 14, 2026Updated 2 months ago
- Some tutorial-style examples for validating machine-learned interatomic potentials☆34Dec 4, 2023Updated 2 years ago
- Utility for applying the distortion symmetry method.☆28Feb 21, 2024Updated 2 years ago
- Generate atomic structures for common defects in materials☆19Apr 22, 2024Updated 2 years ago
- `quansino` is a modular package based on the Atomic Simulation Environment (ASE) for quickly building custom Monte Carlo algorithms☆29Updated this week
- Electronic transport properties from first-principles calculations☆160Updated this week
- 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.
- This repository contains neccessary code to train AnisoNet, an equivariant graph neural network for predicting dielectric tensors of crys…☆13Feb 20, 2026Updated 3 months ago
- 🌟 [NeurIPS '25 Spotlight] Fair and transparent benchmark of machine learning interatomic potentials (MLIPs), beyond basic error metrics …☆100Apr 16, 2026Updated last month
- Python package for calculating thermodynamic potentials from first-principles calculations☆14Dec 22, 2023Updated 2 years ago
- Gaussian and Lorentzian smearing of simulated spectra☆44Oct 8, 2024Updated last year
- py-sc-fermi is a materials modelling code for calculating self-consistent Fermi energies and defect concentrations under thermodynamic eq…☆33Jan 12, 2026Updated 4 months ago
- Statistical Mechanics on Lattices☆96May 14, 2026Updated last week
- ⚗️ matador is an aggregator, manipulator and runner of first-principles calculations, written with a bent towards battery 🔋 electrode ma…☆35Feb 1, 2026Updated 3 months ago
- Generate symmetrized force constants☆27May 19, 2026Updated last week
- Heavyweight plotting tools for ab initio calculations☆251Apr 9, 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.
- Alchemical machine learning interatomic potentials☆34Nov 8, 2024Updated last year
- ⚛ download and manipulate atomistic datasets☆49Nov 25, 2025Updated 6 months ago
- Tutorial exercises for the OPTIMADE API☆17Sep 27, 2023Updated 2 years ago
- MD2D: a python module for accurate determination of diffusion coefficient from molecular dynamics☆22Feb 17, 2023Updated 3 years ago
- A code to generate atomic structure with symmetry☆371Updated this week
- Use time-splits for Materials Project entries for generative modeling benchmarking.☆12Mar 12, 2026Updated 2 months ago
- MatID is a python package for identifying and analyzing atomistic systems based on their structure. MatID is designed to help researchers…☆23Nov 28, 2023Updated 2 years ago