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Field
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software packages. The Person Knowledge, Skills and Experience Expertise in classical molecular mechanics. Knowledge of biomolecular simulation methods. Experience in quantum mechanical calculations
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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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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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Programme? Not funded by a EU programme Is the Job related to staff position within a Research Infrastructure? No Offer Description The Molecular Plasmonics group at the Eindhoven University of Technology has
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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
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-to-olefins, syngas-to-olefins) involve the production of hydrocarbons from renewable raw materials. In addition to periodic density functional theory (DFT), ab initio methods and molecular dynamics (MD
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performance of molecular dynamics studies on molecular diffusion models in membranes. The research is oriented towards the study of the physicochemical behavior of new systems based on paramagnetic ions with
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. Using dynamic covalent chemistry, molecular switches and reversible polymerisation, we’ll explore new ways to tune droplet growth and stability. The goal is to develop design rules for materials with
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students and around 500 members of staff. The Department of Chemistry and Biomedical Sciences has 45 academic staff and is based at the Kalmar campus. The department is a dynamic environment for knowledge