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properties of phase transitions involving magnetism, elasticity, dielectricity, etc. by applying and developing computational methods such as classical and quantum Monte Carlo simulations, molecular dynamics
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Jerzy Haber Institute of Catalysis and Surface Chemistry, Polish Academy of Sciences | Poland | 12 days ago
properties and a variety of potential applications. Application of the molecular dynamics methods combined with the approach based on the thermodynamic models of multicharged surfactant adsorption can provide
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, high-throughput simulations, molecular dynamics, and materials chemistry. Strong Python programming skills are required, and prior experience with developing open-source software or databases will be
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programme Is the Job related to staff position within a Research Infrastructure? No Offer Description We seek a dynamic and proficient individual to contribute to our ongoing research endeavors focused
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molecular dynamics simulations across multiple resolutions, most likely from the atomistic to the coarse grained level, using a variety of force fields and computational methods. Run large-scale simulations
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of novel organic mixed ionic/electronic conductors leveraging AI, quantum chemistry, and molecular dynamics simulations. The candidate will work in close collaboration with experimental groups providing
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. Department: Randall Cell & Molecular Biophysics. Contact details:Maddy Parsons. maddy.parsons@kcl.ac.uk Location: Guy's Campus. Category: Research. About Us The Parsons Group, King’s College London , has
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performing atomistic simulations with Density Functional Theory and Molecular Dynamics. Data analysis and coarse graining in order to provide parametrisations for upper scale models (Kinetic Monte Carlo and
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, while preserving ultimate precision in single-molecule localization and access to key photophysical parameters (fluorescence lifetime, brightness, molecular dynamics). This approach paves the way toward
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application of ultrafast THz-pump and optical-probe techniques to detect narrow-band THz radiation and explore mode-selective dynamics in quantum and molecular systems. This work leverages state-of-the-art