This package makes it easier for you to draw beautiful ternary diagram without pymatgen.
☆21Apr 13, 2026Updated 2 weeks ago
Alternatives and similar repositories for ternary-diagram
Users that are interested in ternary-diagram are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Pymatgen-based script to collect structural descriptors from many atomic structures.☆13Nov 29, 2025Updated 5 months ago
- Python scripts used for the paper "Tuning MXenes towards their Use in Photocatalytic Water Splitting", published in EEM.☆13Nov 15, 2023Updated 2 years ago
- Structural constraint integration in a generative model for the discovery of quantum materials☆31Oct 2, 2025Updated 6 months ago
- Modulated automation of cluster expansion based on atomate2 and Jobflow☆12Apr 14, 2026Updated 2 weeks ago
- parse Grid Engine qstat job info list into a list of python dicts☆11May 19, 2022Updated 3 years ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- A VASP calculation monitor. Written in Rust☆31Mar 30, 2026Updated 3 weeks ago
- ☆14Apr 9, 2025Updated last year
- ☆12Sep 24, 2024Updated last year
- Defect analysis modules for pymatgen☆63Apr 20, 2026Updated last week
- Some examples of using pymatgen code☆23Sep 20, 2024Updated last year
- ☆30Jan 4, 2026Updated 3 months ago
- A program to automatically perform microkinetic modeling and generate microkinetic volcano plots for homogeneous catalysis reactions usin…☆15Updated this week
- A simple way to calculate Gibbs free energy from Vasp calculations☆61Mar 6, 2025Updated last year
- Code complementing the report "Simulating Raman spectra: A CP2K-based implementation and its application to defective graphene nanoribbon…☆12Sep 12, 2020Updated 5 years 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.
- A package for plotting and manipulating 1D spectra☆12Jul 30, 2024Updated last year
- ☆22Dec 1, 2025Updated 4 months ago
- ASE interface for fully constant potential with VASP☆43Oct 14, 2024Updated last year
- Python package for uncertainty quantification in CALPHAD☆12Dec 2, 2024Updated last year
- Crystal structure prediction using neural network potential and age-fitness Pareto genetic algorithm☆14May 5, 2025Updated 11 months ago
- Helpers for working with pymatgen structure graphs.☆12Feb 4, 2025Updated last year
- [ICLR 2024] The implementation for the paper "Space Group Constrained Crystal Generation"☆65Feb 5, 2026Updated 2 months ago
- Tool to analyze the charge evolution in a reaction pathway as derived from the nudged elastic band (NEB) method in VASP☆15Jan 2, 2022Updated 4 years ago
- microkinetic model of chemical reaction, 微观动力学模型总结☆16Sep 17, 2025Updated 7 months ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- Benchmark of crystal structure prediction algorithms☆15Jun 9, 2025Updated 10 months ago
- SCAKS-Hub: A flask-powered web app for micro-kinetics analysis☆12Mar 5, 2019Updated 7 years ago
- Python package for enhancing VASP AIMD simulations and analysis☆13Jul 1, 2025Updated 9 months ago
- Band structure unfolding made easy!☆63Updated this week
- ☆12Jan 29, 2025Updated last year
- Mathematical modelling of Magic the Gathering☆10Aug 9, 2021Updated 4 years ago
- SLABCC: Total energy correction code for charged periodic slab models. Project is currently maintained at https://codeberg.org/meisam/sla…☆17Jan 28, 2025Updated last year
- A simple walkthrough and template for NEB runs on VASP.☆18Jan 28, 2022Updated 4 years ago
- Probabilistic Response mOdel Fitting with Interactive Tools☆15Mar 16, 2026Updated last month
- Virtual machines for every use case on DigitalOcean • AdGet dependable uptime with 99.99% SLA, simple security tools, and predictable monthly pricing with DigitalOcean's virtual machines, called Droplets.
- 机器学习预测表面物种性质 Predict property on surface using machine learning with SOAP encode☆17Dec 27, 2018Updated 7 years ago
- a workflow to do constant potential thermodynamic integration in VASP☆12Dec 19, 2024Updated last year
- DensityTool post-processing program for VASP☆31Nov 29, 2023Updated 2 years ago
- Computes trajectories for evolutionary dynamics.☆15Oct 6, 2020Updated 5 years ago
- Has been replaced so this version is unmaintained: Single Purpose Website for making ternary plots using d3.js☆11Jan 19, 2025Updated last year
- Tutorials of codes such as VASP, Quantum Espresso and Lammps☆14Apr 22, 2026Updated last week
- SAGA: A Security Architecture for Governing AI Agentic Systems☆20Feb 17, 2026Updated 2 months ago