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Jupyter Notebook 123 28 Updated Apr 5, 2024

Repository for "Inverse Design of Hybrid Organic-Inorganic Perovskites with Suitable Bandgaps via Proactive Searching Progress"

Python 2 2 Updated Sep 19, 2023

A python package for accessing various properties of elements, ions and isotopes in the periodic table of elements.

Python 233 47 Updated Jan 7, 2025

Differentiable Quantum Chemistry (only Differentiable Density Functional Theory and Hartree Fock at the moment)

Python 108 14 Updated Mar 13, 2022

Curated list of known efforts in materials informatics, i.e. in modern materials science

402 88 Updated Sep 18, 2024

Tutorials, notebooks, issue tracker, and website on the MPDS API: the data retrieval interface for the Materials Platform for Data Science

HTML 26 5 Updated Jan 16, 2025

Periodic elements data

JavaScript 150 95 Updated Dec 11, 2021

A materials discovery algorithm geared towards exploring high-performance candidates in new chemical spaces.

Python 39 9 Updated Aug 20, 2024

SVM benchmark for prediction of band gaps of semiconductors.

Python 6 1 Updated Mar 13, 2022

A basic git tutorial built for beginners.

HTML 1 Updated Dec 26, 2020

Magnificent app which corrects your previous console command.

Python 89,362 3,596 Updated Jul 19, 2024

quick analysis of vasp calculation

Python 35 14 Updated Jun 7, 2024

Identification of the Dominant Recombination Process for Perovskite Solar Cells Based on Machine Learning

Jupyter Notebook 14 2 Updated Oct 27, 2020

VSCode Extension for interactively visualising protein structure data in the editor

TypeScript 101 9 Updated Nov 28, 2024

A program that converts VASP POSCAR files to crystallographic information file format (CIF)

Python 23 24 Updated Aug 23, 2013

Lecture python code

Python 2 Updated Mar 29, 2022

Data mining for materials science

HTML 496 196 Updated Jan 20, 2025

The Divergent Association Task is a brief measure of creativity

Python 75 20 Updated Apr 22, 2022

Mirror of the Quantum ESPRESSO repository. Please do not post Issues or pull requests here. Use gitlab.com/QEF/q-e instead.

Fortran 578 282 Updated Oct 21, 2024

Learn OpenMP examples step by step

C 87 14 Updated Jan 18, 2025

netcdf4-python: python/numpy interface to the netCDF C library

Cython 763 264 Updated Dec 4, 2024

A Collection of application ideas which can be used to improve your coding skills.

81,837 9,643 Updated Aug 16, 2024

Doğrusal Regresyon kullanarak gıda taşımacılığında populasyon kâr kestirimi uygulaması

Jupyter Notebook 36 3 Updated Jun 27, 2020

Python notebooks with ML and deep learning examples with Azure Machine Learning Python SDK | Microsoft

Jupyter Notebook 4,135 2,524 Updated Dec 16, 2024

A custom data processing extension for Google Analytics to be used in SSRS.

C# 7 1 Updated Sep 18, 2013

A collective list of free APIs

Python 325,321 34,509 Updated Oct 31, 2024

Master programming by recreating your favorite technologies from scratch.

Markdown 327,262 30,329 Updated Sep 3, 2024

📚 Freely available programming books

HTML 348,266 62,638 Updated Jan 12, 2025
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