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functional theory, tight-binding theory, or valence force field methods; Proficiency in PYTHON programming environment. LanguagesENGLISHLevelGood LanguagesPOLISHLevelGood Research FieldChemistry
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functional theory, tight-binding theory, or valence force field methods; Proficiency in PYTHON programming environment. LanguagesENGLISHLevelGood LanguagesPOLISHLevelGood Research FieldChemistry
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in structure characterization of homogeneous and heterogeneous catalysts using nuclear magnetic resonance (NMR) spectroscopy and density functional theory (DFT) to deduce structure-property
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behavior. You will combine density functional theory, thermodynamics, and automated Python-based workflows to generate physically grounded datasets describing oxidation states, defect formation, and surface