<html><body><div style="color:#000; background-color:#fff; font-family:arial, helvetica, sans-serif;font-size:10pt"><div><span>Hi dear wien2k users and dear P. Blaha<br></span></div><div> I am just struck with error. i am using an external electric field and during run_lapw it gives CORE error. when i opend the error file, it gives a message like <br>_________________________________________<br> 'CORE' - NSTOP= 362 positive eigenvalue for 3S Atom: 0 Zn1 <br> 'CORE' - Try to apply a potential shift in case.inc <br>______________________________________________<br></div><div><br></div><div style="color: rgb(0, 0, 0); font-size: 13.3333px; font-family: arial,helvetica,sans-serif;
background-color: transparent; font-style: normal;">my case.in0 is this.<br><br>___________________________________________</div><div>TOT 13 (5...CA-LDA, 13...PBE-GGA, 11...WC-GGA)<br>NR2V IFFT (R2V)<br> 40 40 40 2.00 1 min IFFT-parameters, enhancement factor, iprint<br>30 100.0 (#of FK in E-field expansion, EFELD (Ry)<br>_______________________________________________</div><div style="color: rgb(0, 0, 0); font-size: 13.3333px; font-family: arial,helvetica,sans-serif; background-color: transparent; font-style: normal;">Please help in removing thiss error.<br></div><div><br>Regards: <br>Yasir Ali<br></div></div></body></html>