On 25/10/2014 23:16, Ari P Seitsonen wrote: > > Dear PL Gong, > > Sometimes the things are not that simple to be programmed and > provided to others - please try to learn about the difference between > non-resonant and resonant Raman. > > You can also have a look at the papers of Michele Lazzeri and > Francesco Mauri,
E.g these for the temperature dependence of the Raman modes http://journals.aps.org/prb/pdf/10.1103/PhysRevB.68.220509 http://journals.aps.org/prl/pdf/10.1103/PhysRevLett.99.176802 http://journals.aps.org/prb/pdf/10.1103/PhysRevB.86.121404 Not sure what is published re the shapes - a few groups are/were working on this. nicola ---------------------------------------------------------------------- Prof Nicola Marzari, Chair of Theory and Simulation of Materials, EPFL _______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
