<html>
<head>
<meta http-equiv="Content-Type" content="text/html; charset=iso-8859-1">
<style type="text/css" style="display:none;"> P {margin-top:0;margin-bottom:0;} </style>
</head>
<body dir="ltr">
<div style="font-family: Calibri, Arial, Helvetica, sans-serif; font-size: 12pt; color: rgb(0, 0, 0); background-color: rgb(255, 255, 255);" class="elementToProof">
<span class="x_elementToProof ContentPasted0" style="font-family:Calibri,Arial,Helvetica,sans-serif;font-size:12pt;color:rgb(0,0,0);background-color:rgb(255,255,255)">Dear experts,</span></div>
<div style="font-family: Calibri, Arial, Helvetica, sans-serif; font-size: 12pt; color: rgb(0, 0, 0); background-color: rgb(255, 255, 255);" class="elementToProof">
<div class="x_elementToProof" style="font-family:Calibri,Arial,Helvetica,sans-serif;font-size:12pt;color:rgb(0,0,0);background-color:rgb(255,255,255)">
<br class="ContentPasted0">
</div>
<div class="x_elementToProof ContentPasted0" style="font-family:Calibri,Arial,Helvetica,sans-serif;font-size:12pt;color:rgb(0,0,0);background-color:rgb(255,255,255)">
I tried to run 'vc-relax' calculation using NC pseudopotentials on CuI for GGA+U, but I got the following message in the output :<br class="ContentPasted0">
</div>
<div class="x_elementToProof" style="font-family:Calibri,Arial,Helvetica,sans-serif;font-size:12pt;color:rgb(0,0,0);background-color:rgb(255,255,255)">
<br class="ContentPasted0">
</div>
<div class="x_elementToProof" style="font-family:Calibri,Arial,Helvetica,sans-serif;font-size:12pt;color:rgb(0,0,0);background-color:rgb(255,255,255)">
<br class="ContentPasted0">
</div>
<div class="x_elementToProof ContentPasted0" style="font-family:Calibri,Arial,Helvetica,sans-serif;font-size:12pt;color:rgb(0,0,0);background-color:rgb(255,255,255)">
    Any further DFT definition will be discarded</div>
<div class="x_elementToProof" style="font-family:Calibri,Arial,Helvetica,sans-serif;font-size:12pt;color:rgb(0,0,0);background-color:rgb(255,255,255)">
<pre class="x_ContentPasted0 x_ContentPasted1 ContentPasted0"><div class="ContentPasted0">     Please, verify this is what you really want</div><div><br class="ContentPasted0"></div><div><br class="ContentPasted0"></div><div class="ContentPasted0"> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%</div><div class="ContentPasted0">     Error in routine offset_atom_wfc (1):</div><div class="ContentPasted0">     no atomic wavefunctions in pseudopotential file for species # 1</div><div class="ContentPasted0">use a pseudopotential file with atomic wavefunctions!</div><div class="ContentPasted0"> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%</div><div><br class="ContentPasted0"></div>     stopping ...<br class="ContentPasted0"><br class="ContentPasted0"><br class="ContentPasted0"><br class="ContentPasted0">Dear experts, you will find attached  my input file.<br class="ContentPasted0">How can I fix this problem please!<br class="ContentPasted0"><br class="ContentPasted0"><br class="ContentPasted0"><br class="ContentPasted0"><br class="ContentPasted0"><br class="ContentPasted0"><div style="color:black;background-color:white">
</div>
<div style="color:black;background-color:white"><br class="ContentPasted0"></div><div style="color:black;background-color:white"><br class="ContentPasted0"></div><div style="color:black;background-color:white">
<div class="x_ContentPasted1 ContentPasted0" style="background-color:white">------------------------------------------------------------ </div><div class="x_ContentPasted1" style="background-color:white"><div style="background-color:white"><div style="background-color:white"><span class="x_ContentPasted1 ContentPasted0">Salma NAIMI</span><span></span></div><span style="background-color:white"><span class="x_ContentPasted1 ContentPasted0">PhD student - Mohamed 5 University-Rabat</span></span></div></div></div></pre>
</div>
<br>
</div>
</body>
</html>