GDS-Education-Community-of-Practice / DSECOPLinks
This repository contains data science educational materials developed by DSECOP Fellows.
☆49Updated 2 months ago
Alternatives and similar repositories for DSECOP
Users that are interested in DSECOP are comparing it to the libraries listed below
Sorting:
- A Python module for fast computation of 2D and 3D radial distribution functions (RDFs).☆30Updated last year
- A minimalistic atomic Density Functional Theory (DFT) code☆137Updated this week
- Materials science with Python at the atomic-scale☆212Updated 2 weeks ago
- Materials Learning Algorithms. A framework for machine learning materials properties from first-principles data.☆93Updated this week
- A many-body extension of the FLARE code.☆36Updated 3 years ago
- An python script implementation to solve classical Density Functional Theory for Lennard-Jones fluids on 1D and 3D geometries☆20Updated 9 months ago
- Computational Physics codes☆62Updated 2 years ago
- Educational code for Density Functional Theory and Quantum Monte Carlo with Python☆20Updated 6 years ago
- 1D density functional theory code in Python☆134Updated 2 years ago
- Electronic structure Python package for post analysis and large scale tight-binding DFT/NEGF calculations☆209Updated last week
- LAMMPS input from lammpstutorials.github.io☆44Updated 3 months ago
- Fermi surface generation, analysis and visualisation.☆95Updated 2 weeks ago
- Interactive tutorials for the PIMD Massive Open Online Course☆23Updated last year
- ☆12Updated last month
- computational physics class taught at UNLV (Phys300)☆123Updated 2 years ago
- HOOMD-blue example scripts.☆35Updated last week
- Tool to read a logfile produced by LAMMPS into a simple python data structure with a get()-function providing the log data.☆63Updated 3 months ago
- DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy.☆82Updated this week
- Python Suite for Advanced General Ensemble Simulations☆89Updated last month
- Atomic interaction potentials based on artificial neural networks☆119Updated 3 months ago
- Data Science for Materials Science☆64Updated last week
- A Python library for building atomic neural networks☆115Updated 3 months ago
- Space Group Informed Transformer for Crystalline Materials Generation☆105Updated last week
- This is a collection of answers to a SM book Statistical Mechanics Theory and Molecular simulation written by Mark E. Tuckerman. Lecture…☆35Updated 9 years ago
- Lecture notes and code for the course PHYS6350 Computational Physics at the University of Houston☆176Updated last week
- A collection of Python codes to calculate physical properties from molecular dynamics simulations.☆15Updated last month
- pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LA…☆69Updated last month
- Automatic generation of crystal structure descriptions.☆121Updated last week
- The Active Matter Evaluation Package (AMEP) - a Python library for the analysis of particle-based and continuum simulation data of soft a…☆21Updated last month
- LAMMPS tutorials for both beginners and advanced users: the article☆25Updated this week