Dear experts, I was trying to generate the structure for Rb6Pb5Cl16. It consists of atoms (multiplicity wyckoff letter) Rb1 (4h), Rb2 (4g), Rb3 (2a), Pb1 (4e), Pb/Rb (8k), Cl1 (16l), Cl2 (8j), Cl3 (4g), Cl4 (4f) and space group is P4/mbm. If I generate this structure with this information I am getting Rb10Pb12Cl32. I have tried to split the Pb/Rb (8k) into Pb (6 no) and Rb (2 no), found that nn generates a new struct file and space group changes to c2/m. I am not understanding where I am wrong. Looking forward for some help.
Thank you in advance. -- With regards Anupriya Nyayban Ph.D. Scholar Department of Physics NIT Silchar
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