############################################################################ # Zacros Input File # # # # Multiscale Computational Catalysis and Materials Science Research Group # # Chemical Engineering Department # # University College London # # # # Michail Stamatakis, PhD # ############################################################################ # Disclaimer: this input file is intended as an example only. We make no # # warranties of any kind about the suitability of the contents of this # # file for simulating any physical system, and hold no responsibility for # # any consequences resulting from doing so. # ############################################################################ lattice default_choice rectangular_periodic 1.0 50 50 end_lattice