<div dir="ltr">hello! <div style>I work on compound which have a spinel crystal structure and I'm trying to optimize its lattice parameters.</div><div style>1) I choose some % and I have done 'xoptimiz'</div>
<div style>2) then in 'edit optmiz.job' , I have uncommented : *) xdstart-up #c</div><div style> *) xdstart-dn #c</div><div style> *) runsp_lapw</div>
<div style>3) then I run optimiz.job</div><div style><br></div><div style>BUT I have this error !!!!! </div><div style><br></div><div style>error in LAPW1</div><div> 'INILPW' - can't open unit: 18 </div>
<div> 'INILPW' - filename: essai.vsp </div><div> 'INILPW' - status: old form: formatted </div><div> 'LAPW1' - INILPW aborted unsuccessfully.</div>
<div><br></div><div style><br></div><div style>Can someone tell me please if my steps that I have done are right??? and where is the problem</div><div style><br></div><div style>thanks in advance </div><div style> </div>
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