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. Strong knowledge of heterogeneous catalysis and computational chemistry. Experience with computational modeling (i,e, DFT, and/or molecular dynamics). Familiarity with software such as Material Studio
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analytical tools. Molecular dynamics of semiconductor-oxide interface. Numerical simulations of the oxide condensation process based on force-field data. The topic will require numerical simulations and
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nanocrystals and carry out Brownian and molecular dynamics simulations of their self-assembly behavior in solution, on surfaces, or trapped at fluidfluid interfaces. 2) Carry out free energy calculations using
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molecular dynamics and path integral simulation methods, machine learning techniques, and electronic structure techniques. Additional background in statistical mechanics and deep eutectic solvents is highly
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Hydrogen is expected to play a key role in the energy and fuel mix of future sustainable transport systems. However, due to its small and light molecular structure, hydrogen exhibits significantly
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of tomorrow and creating novel solutions to major global challenges. Our community is made up of 13 000 students, 400 professors, and more than 4 500 other faculty and staff working on our dynamic campus in
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thereafter. The project Currently, plant ingredients are often refined to almost molecular purity - and then combined again to create structured foods. This isolation is resource intensive, and the removal
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full list of publications stating the scientific publications on which the applicant wishes to rely Copy of PhD diploma (if PhD diploma has not yet been received, please include statement from your
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of tomorrow and creating novel solutions to major global challenges. Our community is made up of 13 000 students, 400 professors, and more than 4 500 other faculty and staff working on our dynamic campus in
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. Develop and apply ab initio computations, molecular dynamics simulations, and machine learning models. Collaborate with other researchers within the group and external partners. Present research findings