<p dir="ltr">Dear Wien Users,</p>
<p dir="ltr">I'm trying to do structure optimization for cubic CH3NH3PbI3. The program was failed in lapw2:</p>
<p dir="ltr"> 'FERMI' - EFERMI OUT OF ENERGY RANGE<br>
'FERMI' - STOP IN EFI<br>
'FERMI' - ENERGY OF LOWER BOUND : -11.98650 <br>
'FERMI' - NUMBER OF STATES AT THE LOWER BOUND : 0.00000 <br>
'FERMI' - ENERGY OF UPPER BOUND :3003.01199 <br>
'FERMI' - NUMBER OF STATES AT THE UPPER BOUND : 27.00000 <br>
'FERMI' - ADD 27.00000 <br>
'FERMI' - SOS 0.0000.0000.0000.0000.0000.0000.0000.0000.0001.844 <br>
'FERMI' - NOS ************************************************** <br>
** testerror: Error in Parallel LAPW2<br>
</p>
<p dir="ltr">Please, could you help me?</p>
<p dir="ltr">Best wishes,</p>