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<div id="divRplyFwdMsg" dir="ltr"><font face="Calibri, sans-serif" style="font-size:11pt" color="#000000"><b>De :</b> NM SALMA<br>
<b>Envoyé :</b> mercredi 18 janvier 2023 13:22<br>
<b>À :</b> users@lists.quantum-espresso.org <users@lists.quantum-espresso.org><br>
<b>Objet :</b> How to generate Γ-centered k-point grid ?</font>
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<div class="x_elementToProof"><span class="x_ContentPasted0" style="font-family:Calibri,Helvetica,sans-serif; font-size:12pt; color:rgb(0,0,0); background-color:rgb(255,255,255)">I am doing an exercise to calculate silicon crystal mobility using quantum ESPRESSO
(I found this exercice in one of Quantum ESPRESSO`s tutorials in 2018. It`s the exercice number 2 in the attached file (step 5)).<br class="x_ContentPasted0">
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I'm in a step where i should do a non self-consistent calculation on a 6x6x6 uniform and Γ-centered k-point grid with crystal coordinates in the interval [0,1[.<br class="x_ContentPasted0">
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But i don't know how to generate this grid. Can anyone help me please (I didn't find any tutorial about how to that in the web)?<br class="x_ContentPasted0">
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I want to know also why they chose the interval [0,1[ ?<br>
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