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Field
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nonequilibrium conditions at different length and time scales. Complementary, the candidate will be involved in the comparison between experiments and molecular dynamics simulations of the atomistic dynamics
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and assembly of concrete PCMs. RecyWax+ offers a PhD position for molecular-dynamics simulations of novel PCM systems for thermal storage. Recywax+ is supported within the Dutch Research Council NWO OTP
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thermodynamics. • Investigate molecular recognition mechanisms, including lectin clustering and complex stoichiometry, supported by mass photometry and molecular dynamics simulations. • Integrate biophysical and
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”. In: J. Chem. Phys. 158.3 (2023). [5] : Kästner, J. “Umbrella sampling”. Comp. Mol. Sc., (2011), 1(6), p. 932-942. Techniques/methods in use: Molecular dynamics, Ab-Initio Molecular Dynamics
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Your Job: Modeling and characterization at molecular level of selected biological processes by performing classical molecular dynamics, and employing enhanced sampling methods and machine learning
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) transport; • Are familiar with chemical simulation techniques, including but not limited to density functional theory, molecular dynamics, (kinetic) Monte Carlo modeling, finite-element modeling, and multi
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interatomic-potentials (MLIPs), refined for molten salt mixtures hosting other nuclear material solutes. We will perform density functional theory (DFT) calculations and molecular dynamics (MD) simulations
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and assembly of concrete PCMs. RecyWax+ offers a PhD position for molecular-dynamics simulations of novel PCM systems for thermal storage. Job Description Recywax+ is supported within the Dutch Research
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tumour specific antigens (e.g. EPCAM) in magnetic nanoMIP and fluorescent nanoMIP formats. The doctoral candidate shall support MIP design with molecular modelling and undertake nanoMIP synthesis
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methodology such as Thermodynamic modelling of multi-component planetary degassing/ingassing, Molecular Dynamic simulations of silicate melts, Petrology of melting of exoplanetary mantles, and the partitioning