The workshop will cover a comprehensive discussion of basic methods and applications in the field of novel materials discovery and materials genomics. This includes density-functional theory and many-electron quantum mechanics and developments of multiscale approaches. The latter, is summarized by the appeal "Get Real!", introducing environmental factors (e. g. partial pressures, deposition rates, and temperature) into ab initio calculations. A particular focus of the workshop will be on data-centric scientific concepts and methods (the 4th paradigm of materials science) and the goal that materials-science data must become "Findable and Artificial Intelligence Ready".
The Workshop is aimed at graduate students and postdocs working in the wider field of our NOMAD activities.
The workshop is supported by MS1P e.V. (Molecular Simulations from First Principles).
The conference fee includes 4 nights and full board (from dinner on Sunday to breakfast on Thursday). It is 650 Euro (*). Members of the NOMAD Laboratory pay a reduced fee of 450 Euro.
(*) This fee refers to lodging in a double room with double occupancy. Upgrades come with additional expenses and should be requested to the organizers: NOMAD-WS-2023@fhi.mpg.de