We are hiring: Two Python Developers / Data Scientists
Location: VASP Software GmbH, Vienna, Austria

At the VASP Software GmbH, we develop the leading software for the simulation of condensed matter systems from first principles. We are looking for two talented Python developers or data scientists to join our international team. You will develop machine-learning models for ab-initio properties based on large datasets, contribute to py4vasp, and engage in projects that match your scientific expertise.

We offer you

• The opportunity to focus on software development without the administrative burden typical of research positions.
• To transform and accelerate materials simulations by incorporating the latest machine learning techniques.
• Flexible working hours including working from home (fully remote work is not possible).
• A long-term, competitively paid position without grant or tenure-track constraints.

You are a strong candidate if you

• Have a solid background in Python, especially experience with machine learning libraries (PyTorch, JAX, etc.).
• Have a background in automated data acquisition, data storage and data curation.
• Enjoy code development for scientific applications and want to improve your skills.
• Have a PhD related to first-principles simulations or machine-learning in materials science, chemistry, or physics.
• Have contributed to significant software projects in an academic or an industrial setting.

You stand out if you

• Bring experience in integrating ML frameworks into scientific workflows.
• Have worked with ab-initio simulation tools like VASP or developed scientific software.
• Developed graphical applications for the web browser with JavaScript or Python.
• Have written Fortran or C/C++ code.
• Are familiar with common scientific Python tools like ASE, AiiDA, pymatgen, …
• Have previous expertise in the field of electrochemistry.
• Are familiar with methods beyond density functional theory including but not limited to quantum Monte-Carlo methods.

We encourage candidates of all backgrounds and experiences to apply—if you’re excited about the opportunity, we’d like to hear from you! Please send your CV and a motivational letter to [email protected] (subject: Python Developer / Data Scientist Position) with [email protected] in cc. If possible, please include a link to a GitHub repository displaying your work.
On November 12, 2024, we will begin selecting candidates for an interview.