<div dir="ltr">Actually it is not that simple: apparently one of the values for DFT, either read from pseudopotentials or provided in input, has a malformed syntax.<br><div class="gmail_extra"><br></div><div class="gmail_extra">Paolo<br><br></div><div class="gmail_extra"><div class="gmail_quote">On Thu, Aug 25, 2016 at 2:21 PM, stefano de gironcoli <span dir="ltr"><<a href="mailto:degironc@sissa.it" target="_blank">degironc@sissa.it</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
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<div>Dear Mohammadreza,<br>
the error means that you are using two pseudo-potentials that
have been generated with two different functionals. in particular
the gradient corrected functional for exchange appears to be in
conflict.<br>
check your pseudo-potentials<br>
stefano <br><div><div class="h5">
<br>
On 25/08/2016 14:00, mohammadreza hosseini wrote:<br>
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<blockquote type="cite"><div><div class="h5">
<div style="font-size:13.3333px;font-family:tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal">Dear
giannozzi</div>
<div style="font-size:13.3333px;font-family:tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal"> </div>
<div style="font-size:13.3333px;font-family:tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal">I studied
your message about my error " conflicting igcx value " but i
could not see this part at my pseudo file. What variables are
conflicting exactly ?</div>
<div style="font-size:13.3333px;font-family:tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal"> </div>
<div style="font-size:13.3333px;font-family:tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal">Best</div>
<div style="font-size:13.3333px;font-family:tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal">mohammadreza</div>
<br>
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