Dear developers and users For thermoelectric calculations I want to find "effective mass" of carriers. Is there any way I can calculate it using band-structures (by fitting a polynomial equation), since it is related to the second derivative of energy w.r.t. k. Or else, can we get carrier concentration and carrier's scattering time in BoltzTrap? Best regards. Thank you!! Nileema Sharma
_______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html