Have you tried

cif2struct CH3NH3PbI3_cubic.cif


on a cif file for it?  For example, the CH3NH3PbI3_cubic.cif at:


https://github.com/WMD-group/hybrid-perovskites/tree/master/2015_ch3nh3pbi3_phonons_PBEsol


On 9/4/2017 3:02 AM, AJAY SINGH VERMA wrote:

Dear Sir,

I have facing some problem to generate strcut file of CH3NH3PbI3 for cubic structure. Sir please guide me and help to generate struct file.

thanks

with regards

ajay singh verma

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