Repositories list

• eOn

  Public
  eOn v2 and beyond

  chemistryoptimizationquantum-chemistry+ 3

  chemistryoptimizationquantum-chemistrykmcsaddlepoint-approximationakmc

  C++

  •

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

  •44 forks•1919 stars•4949 issues•2020 pull requests•Updated Sep 23, 2026Sep 23, 2026

• fortran_cuh2_src

  Public
  Fortran source for a Copper Hydrogen potential

  Fortran

  •

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

  •00 forks•00 stars•00 issues•00 pull requests•Updated Jul 25, 2026Jul 25, 2026

• nbfc26

  Public
  Website of the 2026 Nordic Baltic Femtochemistry Conference

  HTML

  •22 forks•00 stars•00 issues•00 pull requests•Updated Jul 7, 2026Jul 7, 2026

• pypotlib

  Public
  Python bindings and ASE adapters for potlib

  Python

  •

  MIT License

  •00 forks•11 star•44 issues•00 pull requests•Updated Jan 22, 2026Jan 22, 2026

• otgpd_repro

  Public
  OTGPD reproducer

  C++

  •

  Other

  •00 forks•11 star•00 issues•00 pull requests•Updated Jan 21, 2026Jan 21, 2026

• gpr_sella_repro

  Public
  Reproduction repository for GPRD-Sella paper

  Fortran

  •

  Other

  •00 forks•00 stars•00 issues•00 pull requests•Updated Jul 8, 2025Jul 8, 2025

• theochem-web

  Public
  Theochem lab website

  SCSS

  •

  MIT License

  •11 fork•00 stars•00 issues•00 pull requests•Updated Feb 4, 2025Feb 4, 2025

• legacy_eongit

  Public
  C++

  •

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

  •44 forks•00 stars•00 issues•00 pull requests•Updated Jul 30, 2024Jul 30, 2024

• eONpy

  Public
  Thin python bindings to the v2 eon client

  Emacs Lisp

  •

  MIT License

  •00 forks•00 stars•00 issues•00 pull requests•Updated Jun 21, 2024Jun 21, 2024

• potlibR

  Public
  Basic R helpers for potlib

  C++

  •

  MIT License

  •00 forks•11 star•00 issues•00 pull requests•Updated Nov 9, 2023Nov 9, 2023

• atomicDists

  Public
  A C++ library for distance calculations

  C++

  •

  MIT License

  •00 forks•11 star•66 issues•00 pull requests•Updated Aug 9, 2023Aug 9, 2023

• mex_cuh2

  Public
  A MATLAB interface to the CuH2 potential of the Jonsson group

  C

  •

  MIT License

  •00 forks•00 stars•00 issues•00 pull requests•Updated Apr 27, 2023Apr 27, 2023