Dear Wien2k users, I want to run a volume optimization for LiFePO4. However, at the first iteration it shows a Ghost Band error. I have attached the struct file (both initial & -2% decreased volume struct) herewith this mail.
Thanks in advance. with regards, -- Dr. Shamik Chakrabarti Research Fellow Department of Physics Indian Institute of Technology Patna Bihta-801103 Patna Bihar, India
LFP_opt.struct
Description: Binary data
LFP_opt_initial.struct
Description: Binary data
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