<html><head><style type="text/css"><!-- DIV {margin:0px;} --></style></head><body><div style="font-family:times new roman, new york, times, serif;font-size:12pt">Dear all..<br>I am trying to do scf calculation of an fe/co nanowire along the bcc (110) direction.<br>However the calculation is not getting converged..after even 100 iterations.. the scf accuarcy is not reached and suddenly the program stops ...<br>can anybody pls tell me if anything is wrong with my input file...<br>the input file is attached<br>any reply would be greatly appreciated<br>regards,<br>asa<br><div> </div><br></div><br>
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