Repositories list

• quacc

  Public
  quacc is a flexible platform for computational materials science and quantum chemistry that is built for the big data era.

  pythonworkflowdatabase+ 7

  pythonworkflowdatabasedftchemistryhpcquantum-mechanicsquantum-chemistryhigh-throughputcomputational-materials-science

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •8080 forks•295295 stars•1111 issues•66 pull requests•Updated Oct 1, 2026Oct 1, 2026

• rosen_style

  Public
  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •00 forks•22 stars•00 issues•00 pull requests•Updated Oct 1, 2026Oct 1, 2026

• template

  Public template
  A template for Python packages. Developed by the @quantum-accelerators

  pythontemplatetutorial

  pythontemplatetutorial

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •66 forks•6363 stars•00 issues•00 pull requests•Updated Oct 1, 2026Oct 1, 2026

• rosen-research-group

  Public
  Astro website for the Rosen Research Group at Princeton University

  Astro

  •00 forks•11 star•00 issues•11 pull request•Updated Sep 30, 2026Sep 30, 2026

• electrai

  Public
  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •22 forks•99 stars•1111 issues•2323 pull requests•Updated Sep 24, 2026Sep 24, 2026

• qmof_thermo

  Public
  Supplementary Data for "Predicting the Thermodynamic Limits of Metal–Organic Framework Metastability"

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •00 forks•44 stars•00 issues•22 pull requests•Updated Aug 3, 2026Aug 3, 2026

• raspa_ase

  Public archive
  ASE calculator for RASPA2

  molecular-simulationsasegcmc+ 1

  molecular-simulationsasegcmcraspa

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •00 forks•1212 stars•22 issues•44 pull requests•Updated Feb 1, 2025Feb 1, 2025

• .github

  Public
  The GitHub profile of the Rosen Research Group

  11 fork•22 stars•00 issues•00 pull requests•Updated May 30, 2023May 30, 2023