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Doctoral or post-doc position in the simulation of mechano- or tribochemical processes in advanced hydrogen storage materials (metal, complex and organic hydrides) and degradation of contaminants in mineral substrates. A 4-year contract at Spanish National Research Council is offered to work in...
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drag reduction in graphene with a combination of electronic structure methods and large-scale atomistic molecular dynamics (MD) powered by machine learning and high-performance computing (HPC). The first
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growth and polymorph selection within the context of the ERC Consolidator Project ht-MATTER - High Throughput Modelling of Molecular Crystals out of Equilibrium. The appointment is for 3.5 years
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Center for Nanomedicine and Tissue Engineering | Tzab it adh, San Luis Potosi | Mexico | about 2 months ago
Milan and is focused on molecular dynamics of Peptides/PNA-based Nanomaterials. The Postdoctoral Researcher will be responsible for conducting computational simulations, analyzing data, and contributing
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Project Title: Quantum and Classical Molecular Dynamics - Accelerated Classical Mechanics Closing Date: 29 April 2024 at 23:59 Eligibility: UK Applicants only Funding EPSRC Doctoral Training
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should allow us to treat bigger molecular systems faster and more accurately. This project is focused on quantum wave packet dynamics. Chemical dynamics is about rearranging nuclei whose motion is often
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interpret the ageing results obtained from the experiments as well as to identify potential new ageing markers. Computational chemical modelling which also called Molecular Dynamic (MD) simulation is becoming
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dynamics, from the molecular to cellular level. This will contribute to our understanding of the fundamental mechanisms that underlie protein stability, drive biological processes and contribute
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analytics and offers a flexible environment for solving the largest and most challenging problems in computational science. Molecular dynamics simulations are very popular on PSC’s flagship supercomputer
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specific emphasis on Molecular Dynamics (MD) simulations and a preference for expertise in protein-RNA simulations. We are seeking a highly motivated and qualified candidate with a strong background in