Hello everyone,
I would like to calculate the optical properties using castep code for a disordered system. So, I have to build an ordered supercell . What is the best supercell for this disordered compound Hg12 Sb6 Br5.186 I6.814?
Hello everyone,
I would like to calculate the optical properties using castep code for a disordered system. So, I have to build an ordered supercell . What is the best supercell for this disordered compound Hg12 Sb6 Br5.186 I6.814?