[Wien] epl: Subscript out of range.

Jian-Xin Zhu jxzhu at lanl.gov
Sun Sep 20 03:53:23 CEST 2009


Dear Prof. Blaha and Wien2k users,

I am running scf calculations using the following command

runsp_lapw -orb -cc 0.001 -i 6 -in1new 1 -p

After the first LAPW0 finishes,  I see a warning

epl: Subscript out of range.

I dig into the package (version wien2k_09.1) and find the variable is  
in write_in1_lapw, which is in turn called by runsp_lapw (and should  
also by run_lapw). As I understand, it is related to the option -in1new.

What can be done to fix it?

Thanks,

Jianxin







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