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<div class="moz-cite-prefix">the general order is<br>
<br>
f(theta)*cos(0*phi), (f(theta)*cos(m*phi),
f(theta)*sin(m*phi),m=1,l)<br>
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so <br>
l=0: s<br>
l=1: pz, px, py<br>
l=2: dz2, dxz, dyz, dx2-y2, dxy<br>
<br>
stefano<br>
<br>
On 02/08/2015 15:05, Raj kamal wrote:<br>
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cite="mid:CABb51f5XZWjA_bBkvamTk6CJrsahMvenEOadxa7jY+LDKoOemA@mail.gmail.com"
type="cite">
<div dir="ltr">dear QE experts,
<div> i need to confirm from the pdos output file which is
Px,Py,Pz orbitals and please explain each column given below
and feature of ldos...thanks in advance.</div>
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<div># E (eV) ldos(E) pdos(E) pdos(E)
pdos(E) </div>
<div>-19.331 -0.263E-06 -0.198E-06 -0.112E-07 -0.532E-07</div>
<div>-19.281 -0.706E-06 -0.517E-06 -0.377E-07 -0.152E-06</div>
<div>-19.231 -0.177E-05 -0.125E-05 -0.119E-06 -0.402E-06</div>
<div>-19.181 -0.413E-05 -0.279E-05 -0.347E-06 -0.987E-06</div>
<div>-19.131 -0.896E-05 -0.577E-05 -0.948E-06 -0.224E-05</div>
<div>-19.081 -0.181E-04 -0.110E-04 -0.240E-05 -0.469E-05</div>
<div>-19.031 -0.338E-04 -0.191E-04 -0.563E-05 -0.904E-05</div>
<div>-18.981 -0.584E-04 -0.302E-04 -0.122E-04 -0.160E-04</div>
<div>-18.931 -0.929E-04 -0.428E-04 -0.242E-04 -0.259E-04</div>
<div>-18.881 -0.135E-03 -0.526E-04 -0.439E-04 -0.381E-04</div>
<div>-18.831 -0.174E-03 -0.521E-04 -0.720E-04 -0.500E-04</div>
<div>-18.781 -0.192E-03 -0.305E-04 -0.105E-03 -0.568E-04</div>
<div>-18.731 -0.156E-03 0.249E-04 -0.130E-03 -0.510E-04</div>
<div>-18.681 -0.226E-04 0.126E-03 -0.126E-03 -0.227E-04</div>
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-- <br>
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<div style="text-align:left"><em><font
style="background-color:rgb(243,243,243)"
color="#999999">Best regards,</font></em></div>
<div style="text-align:left"><em><font
style="background-color:rgb(243,243,243)"
color="#999999">Rajkamal.A.</font></em></div>
<div style="text-align:left"><em><font
style="background-color:rgb(243,243,243)"
color="#999999">Research Scholar,(SRM UNIV).</font></em></div>
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