<table cellspacing="0" cellpadding="0" border="0" ><tr><td valign="top" style="font: inherit;"><DIV>Hello users,</DIV>
<DIV> </DIV>
<DIV>I am calculating the absorption spetrum. If I run the code turbo_lanczos.x after performing the ground state scf, the calculation stops and I get the error message bellow:</DIV>
<DIV> </DIV>
<DIV>*********************************************************************************</DIV>
<DIV>from orthogonalize: error # 1</DIV>
<DIV>degauss with gamma point algorithm</DIV>
<DIV>*********************************************************************************</DIV>
<DIV> </DIV>
<DIV>Could any one help. </DIV>
<DIV> </DIV>
<DIV>Thank you.</DIV>
<DIV> </DIV>
<DIV>Henry Otunga</DIV>
<DIV>Dept. of Physics</DIV>
<DIV>Maseno University</DIV>
<DIV>Kenya</DIV></td></tr></table>