Parameter studies and high performance computing with GeoDict
It is the aim of virtual material engineering to find material structures with optimal properties.
To find those material structures, many simulations with different parameters need to be run.
Hence, the need to automate this process arises.
In this talk, I will
a) show how to define and run parameter studies using the GUI and the new UserModule and
b) show how to create GeoDict macros and execute them through a batch queue on a cluster.