Installation

Requirements

• Python 3.10 or newer

• ASE 3.22.1 or older

Installation from source

We currently only test on Linux systems. On windows we recommend the Windows Subsystem for Linux (WSL). The exact list of dependencies are given in setup.py and all of them will be automatically installed during setup.

git:

The source is available on github, which can be installed using uv as:

$ git clone https://github.com/SINGROUP/Runner.git
$ cd Runner
$ uv sync

To use familiar pip workflow:

$ cd Runner
$ git pull
$ uv pip install . --upgrade