<div dir="ltr"><div class="gmail_default" style="font-family:tahoma,sans-serif">Hello Akemu Rita<br><br></div><div class="gmail_default" style="font-family:tahoma,sans-serif">i can not understand what is your ultimate question. make clear on it. as far as i know your method correct,. by this way i have created super-cells for my systems in past. so make your question clear. <br>
<br></div><div class="gmail_default" style="font-family:tahoma,sans-serif">In Atom section all atomic coordinates are printed in crystal coordinates not in fractional. you can convert it in easy manner.<br></div><div class="gmail_default" style="font-family:tahoma,sans-serif">
<br><br></div></div><div class="gmail_extra"><br clear="all"><div><div dir="ltr"><span style="background-color:rgb(243,243,243)"><span style="color:rgb(0,0,255);font-family:tahoma,sans-serif"><i><span style="font-size:12pt;line-height:115%"><b>------------------------------------<br>
</b></span></i></span><span style="font-family:georgia,serif"><span style="color:rgb(0,0,255);font-family:tahoma,sans-serif"><font><span style="line-height:115%"><b><span style="line-height:115%">Muthu.V</span><span style="line-height:150%"> <br>
Madurai Kamaraj
Universit</span></b></span><span style="line-height:115%"><b><span style="line-height:150%">y</span><span style="line-height:115%"></span></b></span></font></span><span style="font-size:12pt;line-height:115%;color:black;font-family:tahoma,sans-serif"><b><span style="color:rgb(0,0,255)"><span style="font-size:12pt;line-height:115%"><b><span></span></b></span></span></b></span><i><span style="font-size:12pt;line-height:115%;color:black"><b><span style="color:rgb(0,0,255)"><span style="font-family:georgia,serif"><i><span style="font-size:12pt;line-height:115%"><b><br style="font-family:tahoma,sans-serif">
<span style="font-family:tahoma,sans-serif">------------------------------------</span><br></b></span></i></span></span></b></span></i></span></span><br><span style="font-family:georgia,serif"><i><span style="font-size:12pt;line-height:115%;color:black"><b></b></span></i></span></div>
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<br><br><div class="gmail_quote">On Thu, May 1, 2014 at 11:05 AM, <span dir="ltr"><<a href="mailto:xcrysden-request@democritos.it" target="_blank">xcrysden-request@democritos.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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Today's Topics:<br>
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1. Building a supercell (Omamuyovwi Akemu)<br>
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Message: 1<br>
Date: Wed, 30 Apr 2014 06:58:37 -0700 (PDT)<br>
From: Omamuyovwi Akemu <<a href="mailto:omamuyovwiakemu@yahoo.com">omamuyovwiakemu@yahoo.com</a>><br>
Subject: [xcrysden] Building a supercell<br>
To: "<a href="mailto:xcrysden@democritos.it">xcrysden@democritos.it</a>" <<a href="mailto:xcrysden@democritos.it">xcrysden@democritos.it</a>><br>
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Dear Xcrysden User,<br>
<br>
I have searched through the archives on how to use xcrysden to build a supercell.?<br>
<br>