<div dir="ltr"><div><div><div><div>Respected Experts/Friends,<br></div> I installed Quantum espresso-5.2.1 and Wannier90-2.0.1 seperately in my system. Already wannier90-1.2 is installed in quantum espresso-5.2.1 thus bin directory contains pw2wannier.x executable. <br></div>I tried to calculate transport properties of silicon which is in wannier90-2.0.1/examples/example16-withqe. The procedure for calculating silicon transport properties as it is in tutorial guide is as follows <br>1. pw.x < Si.scf > scf.out<br>2. pw.x < Si.nscf > nscf.out<br><b>3. wannier90.x -pp Si<br>4. pw2wannier90.x < Si.pw2wan > pw2wan.out<br>5. wannier90.x Si<br>6. postw90.x Si</b><br><br><br></div>For my calculation i used wannier90.x & postw90.x which is presented in wannier90-2.0.1 folder and pw2wannier.x which is in quantum espresso-5.2.1 folder. I used this because when i use wannier90.x which is in quantum espresso-5.2.1 folder it shows error as boltzwann is not implemented in wannier90-1.0. Is my procedure to calculate transport properties for example16-withqe is right?<br><br><br></div>Thank you<br><div><div><div><div><div><div><div><div class="gmail_signature"><div dir="ltr"><div><div dir="ltr"><div><div><div><div style="margin-left:40px;text-align:right"> With Regards,<br></div><div style="text-align:right">A.Suresh,<br></div></div><div style="text-align:right">Research Scholar,</div></div><div style="text-align:right">Madurai Kamaraj University,<br></div></div><div style="text-align:right">Madurai.<br></div></div></div></div></div></div>
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