Registry for BIG-MAP apps and codes. Find the apps
☆10May 4, 2026Updated this week
Alternatives and similar repositories for big-map-registry
Users that are interested in big-map-registry are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Predict the electronic structure and atomic properties (potential energy, forces, and stress tensor) of polymers containing N and/or O.☆24Sep 3, 2024Updated last year
- Quantum ESPRESSO Calculator for Atomic Simulation Environment (ASE).☆17Jul 15, 2023Updated 2 years ago
- Code for analyzing our published lithium-ion battery aging data. Includes data loading, outlier correction, feature extraction (capacity,…☆20Sep 24, 2024Updated last year
- Implements core functions for AiiDAlab.☆16May 1, 2026Updated last week
- An app for high-throughput analysis of spectra☆13Jan 21, 2025Updated last year
- 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.
- The nDTomo software suite contains python scripts for the simulation, visualisation, pre-processing and analysis of X-ray chemical imagin…☆50Mar 30, 2026Updated last month
- User-friendly Freeware for Determining the Concentration of Electrolyte Components in Lithium-Ion Cells Using Fourier Transform Infrared …☆14Dec 8, 2022Updated 3 years ago
- Supporting material for the review of continuum models by Brosa Planella et al (2022).☆15Jul 25, 2022Updated 3 years ago
- Repository for the paper "multiscale coupling of surface temperature with solid diffusion in large lithium-ion pouch cells"☆14Nov 3, 2023Updated 2 years ago
- Post-processing toolkit for electronic structure calculations☆18Mar 17, 2026Updated last month
- AiiDA plugin of the high-performance density functional theory code JuKKR (www.judft.de) for high-throughput electronic structure calcula…☆16Apr 29, 2026Updated last week
- An interface between the Materials Project software suite and the Schrodinger Python API, designed to allow for high-throughput execution…☆13Apr 8, 2024Updated 2 years ago
- An implementation of an efficient "object store" (actually, a key-value store) writing files on disk and not requiring a running server☆16Updated this week
- An open-source platform for automated storage of battery data with advanced metadata support☆37Feb 1, 2024Updated 2 years ago
- 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.
- Minimalistic and fast HTML5 visualization of chemical structures in CIF, POSCAR, and OPTIMADE formats☆28Jan 9, 2026Updated 4 months ago
- A JupyterLab extension to run and hide code cells.☆41Apr 15, 2026Updated 3 weeks ago
- Python module for drawing and rendering ASE (Atomic Simulation Environment) atoms and molecules objects using blender.☆13May 29, 2022Updated 3 years ago
- X3D for Atomic Simulation Environment☆15Nov 8, 2020Updated 5 years ago
- Efficiently design and manage flexible workflows with AiiDA, featuring an interactive GUI, checkpoints, provenance tracking, and remote e…☆27Apr 13, 2026Updated 3 weeks ago
- MOVED → https://github.com/paiml/aprender (crates/aprender-orchestrate)☆25Apr 6, 2026Updated last month
- MATBOX is an open-source MATLAB toolbox dedicated to microstructure analsyis of porous/heterogeneous materials☆72Feb 17, 2026Updated 2 months ago
- Hierarchical Bayesian inversion of electrochemical impedance spectroscopy (EIS) data☆15Jan 12, 2025Updated last year
- machine learning interatomic potentials aiida plugin☆25Apr 24, 2026Updated 2 weeks 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.
- Tutorials, notebooks, issue tracker, and website on the MPDS API: the data retrieval interface for the Materials Platform for Data Scienc…☆26Jan 24, 2026Updated 3 months ago
- Estimate the self-diffusion coefficient of a trajectory with a Generalized Least Squares (GLS) optimization procedure.☆16Aug 12, 2022Updated 3 years ago
- Machine learning exercises for the MolSim course (http://www.acmm.nl/molsim/molsim2023/index.html)☆28Jan 16, 2024Updated 2 years ago
- FoKL-GP implements Karhunen-Loève decomposed Gaussian processes with built-in forward variable selection. Decomposed GPs are key to embed…☆18Apr 29, 2026Updated last week
- Nanoreactor analysis codes (not yet released)☆12Apr 24, 2023Updated 3 years ago
- python enhancements of ase.calculators.vasp☆28Jun 3, 2016Updated 9 years ago
- Create reduced-order state-space models for lithium-ion batteries utilising realisation algorithms.☆34Aug 18, 2024Updated last year
- CP2K containers☆17Aug 19, 2025Updated 8 months ago
- ☆12May 15, 2025Updated 11 months ago
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- A widget to visualize and edit atomic structures in Jupyter Notebook☆47Feb 20, 2026Updated 2 months ago
- Crystallographic files of common materials, elements, oxides, for visualization in Avogadro☆20Apr 1, 2026Updated last month
- Parameter optimisation for PyBaMM.☆43Oct 31, 2025Updated 6 months ago
- A Battery Interface Ontology based on EMMO☆54Apr 30, 2026Updated last week
- ☆15Nov 7, 2022Updated 3 years ago
- AI-powered CLI tool for automated electrochemical impedance spectroscopy (EIS) data analysis☆13Jan 21, 2025Updated last year
- A parameterisation and optimisation package for battery models.☆196Updated this week