Transiesta cannot take into account the electron-phonon self-energy. However, tbtrans (phtrans) can calculate phonon transport. If this is what you mean? Please see the manual for how to use phtrans. For a technical description of what is currently available in transiesta/tbtrans you may find this pre-print interesting: https://arxiv.org/abs/1607.04464
2016-09-02 1:18 GMT+02:00 Xiaoming Wang <xw...@rci.rutgers.edu>: > Can this version of Transiesta deal with phonon transport? > > > > Best, > > Xiaoming Wang > > Rutgers.U > > > > *From:* siesta-l-requ...@uam.es [mailto:siesta-l-requ...@uam.es] *On > Behalf Of *Nick Papior > *Sent:* Wednesday, August 31, 2016 6:02 AM > *To:* siesta-l@uam.es > *Subject:* [SIESTA-L] Beta-release of Siesta 4.1 (b1) > > > > We are pleased to announce the release of Siesta-4.1-b1. > > > > This version is a major step in development for Siesta and introduces many > new features. > > We encourage all users to test this beta version but advice to compare > against Siesta 4.0 as this is a beta release. > > > > Please read the Release Notes shipped with the sources which may be found > here: > > > > http://launchpad.net/siesta/4.1/4.1-b1 > > > > Note in particular the BACKWARD COMPATIBILITY ISSUES section in the > Release Notes for some important issues regarding backwards compatibility > with prior versions. > > > > See the file REPORTING_BUGS in the Docs/ directory of the distribution for > instructions to report bugs and suggestions. > > > > Some of the introduced features are: > > - LDA+U > > - Spin-orbit coupling > > - PEXSI method for exa-scale calculations > > - MRRR diagonalization > > - ELPA diagonalization > > - N-electrode TranSiesta with improved performance > > > > > > On behalf of the Siesta team > > > -- Kind regards Nick
