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, Computer Science, or related disciplines. Knowledge and Professional Experience: · Knowledge of programming languages used in data analysis (particularly python) is strongly recommended. · High Performance
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to) SIESTA (www.siesta-project.org) and its TranSIESTA functionality. SIESTA is a multipurpose first-principles method and program, based on Density Functional Theory, which can be used to describe the atomic
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of Group/Project: We are building an optimisation-driven framework that makes AI models reliably operate advanced scientific software (e.g., DFT, Wannierisation, and quantum-transport codes) and (ii) uses
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NanoChemistry and Materials Group (NANOUP) is focused on controlling the supramolecular assembly of molecules, biomolecules and nanoscale building blocks at the nanometer scale for the design of novel functional
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NanoChemistry and Materials Group (NANOUP) is focused on controlling the supramolecular assembly of molecules, biomolecules and nanoscale building blocks at the nanometer scale for the design of novel functional