[Wien] LDA + U uporb.def failed

[Benbella DJELTI]

Dear all,
I am very new to LDA+U calculation. I am running wien2K version 11.1 (2011) on a machine of type Intel i7 with operating system Debian 7.6, fortran compiler XE 12.0 and math libraries 10.3.
- The purpose of my calculations is to get structure propreties With LSDA+U calculation.

- I am running this case (Ba2MnMoO6.struct) using this input (RKMAX=7, MaxLinWF=10 and V-NMT=4) and these commands ( runsp_lapw -ec 0.0001 -orb from w2web). I apply the U values in 2nd (Mn) and 3rd (Mo) atoms using case.inorb and case.indm files.

- The program stops at  the second cycle of optimize.job outputing this message :"forrtl: severe (64): input conversion error, unit 5,file /home/djelti/WIEN2k/Ba2MnMoO6/Ba2MnMoO6.inorb"


- This is the bottom of the file case.dayfile : "error : command  /home/djelti/wien2k/orb  uporb.def  failed"
- You find more details in attached file.
Kind Regards B. DJELTIUniversity of Mostaganem, Algeria
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