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of Prof. Georg Madsen, with regular shorter research stays at Aarhus University. The project combines density functional theory (DFT), machine-learned force fields and atomistic simulations to uncover
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experience in bio- or chemical catalyst design and materials characterization by standard techniques ( NMR , IR, Mass spectrometry, X-ray diffraction, TEM , and DFT calculations desirable). The Zaleski Lab is
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. Perform supporting computations such as DFT calculations. • Contributing toward novel experiment design. • Liaising with international team to coordinate remote experiments and write beamline
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, TEM , and DFT calculations also desirable). The Zaleski Lab is a dynamic multidisciplinary laboratory environment. The successful applicant will play an integral role within our growing team and will
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characterization of starting materials and reaction products by standard techniques ( NMR , IR, Mass spectrometry, X-ray diffraction, TEM , and DFT calculations also desirable). The Zaleski Lab is a dynamic
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synchrotron analysis, as well as with theoretical researchers specializing in atomistic simulation, density functional theory (DFT), and ab initio molecular dynamics (AIMD). The successful candidate
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Postdoc in first-principles modelling and machine-learned force fields for correlated disorder in...
University. The project combines density functional theory (DFT), machine-learned force fields and atomistic simulations to uncover how correlated structural disorder controls transport and other functional
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years (including PhD thesis research) of experience in DFT-based first-principles calculations. Strong written and oral communication skills are essential, along with the ability to work both
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and retrosynthetic analysis software (e.g., AiZynthFinder, ASKCOS, IBM RXN). Familiarity with reaction condition prediction and reaction yield optimization. Exposure to quantum chemistry (DFT) and
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University of North Carolina at Chapel Hill | Chapel Hill, North Carolina | United States | about 2 months ago
a record of scientific writing. DFT /MD modeling expertise. Familiar with Python and Linux Special Physical/Mental Requirements Special Instructions For information on UNC Postdoctoral Benefits and