<html><body><div style="color:#000; background-color:#fff; font-family:times new roman, new york, times, serif;font-size:12pt"><div><span></span></div><div style="font-family: times new roman, new york, times, serif; font-size: 12pt;"><div style="font-family: times new roman, new york, times, serif; font-size: 12pt;"><div id="yiv247352233"><div><div style="color:#000;background-color:#fff;font-family:times new roman, new york, times, serif;font-size:12pt;"><div>Dear wien 2k users ,</div><div><br></div><div>i am doing non spin polarized calculation and i want to calculate partial charges in DOS. but when i click in DOS on x lapw2 -qtl -c -p with option calculate partial charges it gives this error.</div><pre style="color:rgb(192, 0, 0);">running LAPW2 in parallel mode
calculating QTL's from parallel vectors
FERMI - Error
0.084u 0.124s 0:00.32 62.5% 0+0k 0+0io 0pf+0w
(standard_in) 1: parse error
(standard_in) 1: parse error
(standard_in) 1: parse error
(standard_in) 1: parse error
(standard_in) 1: parse error
(standard_in) 1: parse error
(standard_in) 1: parse error
(standard_in) 1: parse error<br><br><span style="color:rgb(0, 0, 0);">when i saw error files in lapw2.error file, this error message is printed there</span><br><br> Error in LAPW2<br> 'LAPW2' - can't open unit: 30 <br> 'LAPW2' - filename: GBG-2.energyso_1</pre><div>i don't know how to solve this and why this error occurred.</div><div><br></div><div>Please guide me how to solve this. i will be very grateful to you.</div><div><br></div><div>Best Regards</div><div>Arqum Hashmi<br></div></div></div></div><br><br> </div> </div> </div></body></html>