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<span data-ogsc="black" style="font-size: 12pt; margin: 0px; color: black; background-color: rgb(255, 255, 255);" class="ContentPasted0">Hi!</span></div>
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<span style="margin:0px" class="ContentPasted0">I would like to calculate the fat phonon bands for a chosen material (for simplicity, suppose GaAs), similarily as in Fig. 3 of reference [1]. This is effectively the analogue of projected band structure for phonon
dispersion: information about which atoms contribute the specific modes to what degree. </span><br class="ContentPasted0">
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Is it possible to obtain such a "projected phonon-band" structure using Quantum Espresso? I haven't found anything so far. </div>
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If not, is it possible to get at least *some* information regarding the atomic contributions to the phonon bands? Or are there 3rd-party post-QE codes that could obtain this info?</div>
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Thanks, and best regards,</div>
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Gergely Nagy (@ ELI-ALPS)</div>
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<span data-ogsc="black" style="font-size: 12pt; font-family: Calibri, Helvetica, sans-serif; margin: 0px; color: black;" class="ContentPasted0">[1] Ha, V.-A., Yu, G., Ricci, F., Dahliah, D., van Setten, M. J., Giantomassi, M., Rignanese, G.-M., & Hautier, G.
(2019). Computationally driven high-throughput identification of CaTe and <span style="margin:0px" class="ContentPasted0">Li</span><span style="margin:0px" class="ContentPasted0">3</span><span style="margin:0px" class="ContentPasted0">Sb</span><span style="margin:0px" class="ContentPasted0"> as
promising candidates for high-mobility </span><span style="margin:0px" class="ContentPasted0">p</span><span style="margin:0px" class="ContentPasted0">-type transparent conducting materials.</span><span style="margin:0px" class="ContentPasted0"><span class="ContentPasted0"> </span>In
Physical Review Materials (Vol. 3, Issue 3). American Physical Society (APS).<span class="ContentPasted0"> </span></span><a href="https://doi.org/10.1103/physrevmaterials.3.034601" target="_blank" rel="noopener noreferrer" data-auth="NotApplicable" data-ogsc="" data-linkindex="0" style="margin:0px" class="ContentPasted0">https://doi.org/10.1103/physrevmaterials.3.034601</a></span></div>
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<span style="margin: 0px; font-size: 10pt; font-family: arial, sans-serif; color: rgb(0, 0, 0); background-color: rgba(0, 0, 0, 0);"><b>Gergely Nagy</b></span><span style="margin: 0px; font-size: 11pt; font-family: arial, sans-serif; color: rgb(251, 99, 3); background-color: rgba(0, 0, 0, 0);"><b><span style="font-size:10pt"> </span></b></span><span style="margin: 0px; font-size: 11pt; color: rgb(0, 0, 0);"><span style="margin: 0px; font-weight: bold; font-family: arial, sans-serif; font-size: 10pt; color: rgb(251, 99, 3); background-color: rgba(0, 0, 0, 0);">|</span><span style="margin: 0px; font-weight: bold; font-family: arial, sans-serif; color: rgb(251, 99, 3); background-color: rgba(0, 0, 0, 0);"><span>
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