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be done via computer simulations, including Monte Carlo and molecular dynamics, combined with the use of statistical mechanics to predict e.g. phase transitions, nucleation rates, etc. The work will be
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environment featuring a wide range of research activities, including QM/MM simulations, ionic liquid simulations, and excited-state characterization. The aim of this PhD thesis is the atomistic modeling
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, including 180 permanent staff (researchers, professors, engineers, technicians, and administrative personnel) and around 180 non-permanent staff (PhD students, postdocs, and fixed-term contracts). Each year
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