As one of the leading automotive suppliers worldwide, we develop solutions to fulfill people´s dreams of mobility on a daily basis. Driver safety, sustainability and industrialization of future technology are just some of our key fields where we already make a meaningful difference in the everyday life of people. Knowing our technology helps to make the world a better and safer place is what drives us. **Key Targets of the Job:** + Develop and optimize computational workflows integrating quantum simulations, molecular descriptors, and predictive machine learning models + Apply advanced cheminformatics and data-driven approaches for virtual screening, property prediction, and reaction mechanism analysis + Design and implement automated pipelines for high-throughput quantum chemical calculations and machine learning model training + Model and simulate complex chemical reaction mechanisms across diverse environments using quantum mechanical and ML-assisted approaches + Analyze simulation results to extract molecular-level insights and support experimental design or product development + Conduct comprehensive literature reviews and generate high-quality technical documentation, reports, and presentations + Collaborate effectively within an interdisciplinary team of computational scientists, chemists, physicists, and materials engineers + Support external collaborations, joint research projects, and technology scouting initiatives + Demonstrate a willingness to travel occasionally for project meetings, conferences, and collaborative activities + PhD in quantum chemistry, computational chemistry, cheminformatics, materials science, physics, or a closely related field (mandatory academic background **)** + Proven hands-on experience with quantum chemistry methods (e.g., DFT, ab initio) and related software (e.g., Gaussian, ORCA, VASP, CP2K, DMol³) + Strong background in cheminformatics, including experience with molecular representations and libraries such as RDKit and Open Babel + Demonstrated ability to incorporate machine learning (e.g., scikit-learn, PyTorch, TensorFlow) into computational chemistry workflows + Experience in modeling reaction mechanisms, energy landscapes, or catalytic processes at the atomic or molecular level - good to have + Proficiency in Python (preferred), along with experience using scientific computing libraries such as NumPy, pandas, and ASE + Familiarity with molecular dynamics tools (e.g., GROMACS, LAMMPS) is a plus + Postdoctoral or several years of industrial experience in the field is highly preferred + Excellent written and spoken English communication skills, with the ability to articulate complex technical concepts to diverse audiences + Strong analytical thinking, creativity, and a proactive, solution-oriented approach to problem solving + Ability to work independently and collaboratively within cross-functional and interdisciplinary teams + Portuguese languages skills written and spoken is a plus ▪ Integration in a challenging and international work environment, featured by the existence of state-of-the-art technologies ▪ Local employment contract with attractive remuneration package and benefits ▪ Continuous professional training and excellent possibilities of personal and professional development Ready to drive with Continental? Take the first step and fill in the online application.