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Mathematical Modeling and Computational Implementation Specialist

vor 2 Monaten


Berlin, Berlin, Deutschland Freie Universität Berlin Vollzeit

Research Opportunity:
We are seeking a highly skilled researcher to collaborate on the project "Mathematical model and computational implementation of open quantum systems for molecular simulations."

The successful candidate will contribute to the development of a rigorous mathematical model of open molecular systems with quantum/electronic degrees of freedom and implement it in an adaptive resolution simulation code framework. The resulting code will be applicable to quantum/electronic calculations that cannot be efficiently performed with current simulation tools.

This project aims to bridge the gap between complex mathematical models and computational techniques, enabling the systematic translation of mathematical models into simulation codes. The work requires a strong background in applied mathematics for theoretical physics and chemistry, as well as experience in using ab initio molecular dynamics codes.

Requirements:
Doctoral degree in Computational Physics, Computational Chemistry, or applied Mathematics/Scientific Computing.

Responsibilities:
Implement a mathematical model of open systems in a code of molecular dynamics/electronic structure, ensuring the code is openly available and user-friendly to users and potential future contributors of the applied and theoretical community.