Dear Prof. Blaha, Thank you very much for your helps and comments about radial mesh.
I have set the energy parameter in case.in1 to EF and rerun lapw1, lapw2 for several calculations using different RMT parameters (other parameters are same). The results are fine in some calculations. But errors (no energy limits found for... and so on) are shown in lapw1 in other calculations. Then, I have changed 'STOP' to 'CONT' in case.in1 and rerun lapw1, but gone wrong. Do I have to run again SCF cycles with using reduced mixing factor and EF decided by first SCF cycles? Thanks in advance. Regards, Shin-ya Ayukawa
