https://github.com/pranabdas/openmx
Density Functional Theory calculation using OpenMX.
https://github.com/pranabdas/openmx
beginner density-functional-theory dft high-performance-computing hpc openmx tutorial
Last synced: 5 months ago
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Density Functional Theory calculation using OpenMX.
- Host: GitHub
- URL: https://github.com/pranabdas/openmx
- Owner: pranabdas
- Created: 2021-08-12T11:43:46.000Z (over 4 years ago)
- Default Branch: main
- Last Pushed: 2025-07-22T03:46:14.000Z (6 months ago)
- Last Synced: 2025-07-22T05:35:39.880Z (6 months ago)
- Topics: beginner, density-functional-theory, dft, high-performance-computing, hpc, openmx, tutorial
- Language: Jupyter Notebook
- Homepage: https://pranabdas.github.io/openmx/
- Size: 9.5 MB
- Stars: 8
- Watchers: 0
- Forks: 2
- Open Issues: 0
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Metadata Files:
- Readme: README.md
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README
DFT calculation using OpenMX
This repository contains various input files, Jupyter notebooks, and other
source files used in my OpenMX tutorial. Please follow the tutorial here -