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<DIV><FONT face=Arial size=2>Dear all users:</FONT></DIV>
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<DIV>I simulate MoS2 cluster with spin-polarized calculations.(atom per cell=26 , k-point=200 , GGA PW91, RMT*KMAX=7)</DIV>
<DIV>I have trouble error after initialization since i begin SCF run.</DIV>
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<P class=MsoNormal dir=rtl style="MARGIN: 0cm 0cm 0pt; TEXT-ALIGN: left" align=right><EM><STRONG><SPAN dir=ltr>PGFIO-F-231/formatted read/unit=8/error on data conversion</SPAN><SPAN dir=rtl></SPAN><SPAN lang=FA><SPAN dir=rtl></SPAN>.</SPAN></STRONG></EM></P>
<P class=MsoNormal dir=rtl style="MARGIN: 0cm 0cm 0pt; TEXT-ALIGN: left" align=right><EM><STRONG><SPAN lang=FA><SPAN> </SPAN></SPAN><SPAN dir=ltr>File name = superedgevacancy.clmsum<SPAN> </SPAN>formatted, sequential access<SPAN> </SPAN>record = 127614</SPAN><SPAN lang=FA></SPAN></STRONG></EM></P><EM><STRONG><SPAN lang=FA dir=rtl style="FONT-SIZE: 12pt; FONT-FAMILY: 'Times New Roman'"><SPAN> </SPAN></SPAN><SPAN style="FONT-SIZE: 12pt; FONT-FAMILY: 'Times New Roman'">In source file lapw0.F, at line number 396</SPAN></STRONG></EM> </DIV>
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<DIV>Please give me your experiences.</DIV>
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<DIV>Regards.</DIV>
<DIV>R.Shidpoor</DIV></DIV></DIV></div><br>
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