PXRD raw data and modelling files for unsupported in-situ MoS2

This dataset contains PXRD data for in-situ generated MoS2 nanoparticles; raw data as well as simulation files. Due to initial mislabeling of a structure file, some of the simulation files contain references to 4H-MoS2 where 2H-MoS2 is expected; this could not easily be changed without breaking the simulation code and so was left in.