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molecular dynamics simulations across multiple resolutions, most likely from the atomistic to the coarse grained level, using a variety of force fields and computational methods. Run large-scale simulations
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: Atomistic & Molecular Modelling for Catalysis Group Where to apply Website https://cicenergigune.com/en/employment-opportunities/111296823 Requirements Research FieldChemistryEducation LevelPhD or equivalent
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. Developing workflows and machine learning algorithms to accelerate catalyst design (optional). Group: Atomistic & Molecular Modelling for Catalysis Group Requirements Specific Requirements PhD in Chemistry
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broad experience in the development of electronic structure methods and their application in order to perform atomistic simulations of molecules and materials. These include (but are not restricted