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: Design, implementation and testing of new methods and algorithms so that SIESTA can harness the compute power of the latest generation of (pre-)exascale architectures and tackle novel scientific challenges
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optimiser that accelerates both workflow efficiency and materials discovery. Main Tasks and responsibilities: Own the optimiser: design, implement, and tune heuristic/metaheuristic algorithms (e.g
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: Design, implementation and testing of new methods and algorithms so that SIESTA can harness the compute power of the latest generation of (pre-)exascale architectures and tackle novel scientific challenges
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. Minoru Otani). The post holder will undertake the following tasks: Contribution to the design, implementation, testing and demonstration of new methodologies and algorithms for the study of electrochemical