<div dir="ltr"><div><div><div>Hi,<br></div> In wein2k_14 version, wannier90 also compiled with wien2k?<br></div><div>At the stage of wanner90.x -pp <br></div> I am getting this error<br>/home/wien2k_14_installation/wannier90: line 156: wannier90.x: command not found<br>0.0u 0.0s 0:00.00 0.0% 0+0k 0+0io 0pf+0w<br><br></div>I have to separately download and install wannier90 and add the path in bashrc?<br><div><br></div></div><div class="gmail_extra"><br><div class="gmail_quote">On Mon, Mar 9, 2015 at 9:22 PM, wasim raja Mondal <span dir="ltr"><<a href="mailto:wasimr.mondal@gmail.com" target="_blank">wasimr.mondal@gmail.com</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div dir="ltr"><div><div><div><div>Hi Ellias,<br></div> Thanks. In 1.0 version when I am using write_inwf , it tells to give <br>next proj. (3 to go; Ctrl-D if done)? V 2<br>didn't catch that: SITE and ORB must be given<br><br></div>what I have to give for SrVO3?<br><br></div>Regards<span class="HOEnZb"><font color="#888888"><br></font></span></div><span class="HOEnZb"><font color="#888888">wasim<br></font></span></div><div class="HOEnZb"><div class="h5"><div class="gmail_extra"><br><div class="gmail_quote">On Mon, Mar 9, 2015 at 8:06 PM, Elias Assmann <span dir="ltr"><<a href="mailto:elias.assmann@gmail.com" target="_blank">elias.assmann@gmail.com</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">Hi Wasim,<br>
<br>
Of course it is possible to produce plots (in psink+psiarg but also xsf format) using pre-1.0 wien2wannier (the last version was 0.97). If the problem is really the conversion to xsf, you should also be able to use the wplot2xsf script from the new wien2wannier version to do this conversion, regardless of where your psink/psiarg files came from. (That script is one of the things that changed a lot)<br>
<br>
However, I would recommend upgrading to Wien2k 14.2. This is of course the standard advice, but I think it applies especially to wien2wannier since so much has changed from 0.x to 1.0, and it is probably more trouble than it would ever be worth to “backport” wien2wannier 1.0 to Wien2k 13.<br>
<br>
Elias<div><div><br>
<br>
<br>
On 03/09/2015 02:27 PM, wasim raja Mondal wrote:<br>
</div></div><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div><div>
Dear Ellias,<br>
I was using wien2k version 13 and wien2wannier version<br>
0.96. With this version of wienwannier interface I am not able to plot<br>
wannier function. I am using SrVO3 example. I able to create case<br>
m.psiarg and case.psink but not creat XSF file to visualize in xcrsden.<br>
So my question is following<br>
<br>
<br>
1. Is this bugs with version 0.96 of wien2wannier interface?<br>
<br>
2. I have to install new veriosn (1.0)? If yes, then I have to install<br>
wienk_14? With wien2k_14 , wien2k_wannier interface will be<br>
automatically install? Wannier90 also? or I have to install separately<br>
install wannier90?<br>
<br>
<br>
3. Is it possible to install this interface with wanneir13?<br>
<br>
<br>
Regards<br>
wasim<br>
<br>
<br></div></div>
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