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<DIV><FONT face=Arial size=2> Hello Wien Users,</FONT></DIV>
<DIV><FONT face=Arial size=2>I had posted the following message a few days back
but did not receive an answer. Could anyone please help me with it. I am
stuck!</FONT></DIV>
<DIV><FONT face=Arial size=2>I am trying to run init_phonon_lapw with a
supercell (2x2x2) of cubic SiC constructed with Phonon. I transferred the .d45
file to Wien2k and ran init_phonon-lapw and got the error message :</DIV>
<DIV><FONT face=Arial size=2>Mult not equal Please check outputnn</FONT></DIV>
<DIV><FONT face=Arial size=2>ityp not equal Please check outputnn</FONT></DIV>
<DIV><FONT face=Arial size=2></FONT> </DIV>
<DIV><FONT face=Arial size=2>In Phonon I used 'Number of non-equivalent
displacive particles" = 2 and 'Number of non-equivalent elastic particles"
= 0, Cell dimensions were the minimum obtained from
Wien2k volume optimisation, displacement for HF forces + 0.025
Ang. </FONT></DIV>
<DIV><FONT face=Arial size=2>Can anybody please suggest how I could correct
this.</FONT></DIV>
<DIV><FONT face=Arial size=2>Thank you in advance,</FONT></DIV>
<DIV><FONT face=Arial size=2>Chandrika</FONT></DIV></FONT></BODY></HTML>