during optimization i am getting following error.
can you tell me what is the good rkmax for PdH.
ERROR status in PdH_vol___-3.00
>   stop error

(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
STOP LAPW2: semicore band-ranges too large
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