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. Some experience with first-principle methods (FP/DFT) and/or other forms of electronic and magnetic structure theory and calculations is also expected. The successful candidate will have a strong
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of) a PhD in organic chemistry and/or supramolecular chemistry. Experience with supramolecular chemistry, vesicle-based assays, DFT calculations, photophysical characterisation and/or cell biology will be
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molecular photoswitches and photochromic systems. Skills in DFT calculations and data interpretation. Publications in peer-reviewed international journals. LanguagesENGLISHLevelExcellent Research
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validate the predictions of the ML models by means of atomistic modeling, in particular density functional theory (DFT) calculations, obtaining simulated electronic and emission spectra for the CDs. Finally
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. Applicants will be required to hold (or be near to completion of) a PhD in organic chemistry and/or supramolecular chemistry. Experience with supramolecular chemistry, vesicle-based assays, DFT calculations
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assessment of CCUS value chains Reactor design, optimization, and sizing using phenomenological and/or CFD methods DFT and Molecular modelling linked to CCUS Strong analytical and problem-solving skills, with
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of) a PhD in organic chemistry and/or supramolecular chemistry. Experience with supramolecular chemistry, vesicle-based assays, DFT calculations, photophysical characterisation and/or cell biology will be
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model development, along with proficiency in programming (e.g., Mathematica, Python), is expected. Basic familiarity with density-functional theory (DFT) or similar computational methods is welcome
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hydrogen generation, using density functional theory (DFT) and its time-dependent extension (TDDFT). 2. In silico design and characterization of new photosensitizers for green hydrogen generation, using
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documentation, and support dissemination activities through presentations and publications Where to apply Website https://www.uam.es/uam/investigacion/ofertas-empleo/contrato-conjuntanoviembre2… Requirements