Data for "Lattice dynamics and electron-phonon coupling calculations using non-diagonal supercells"
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Description
All relevant data present in "Lattice dynamics and electron-phonon coupling calculations using non-diagonal supercells"
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Software / Usage instructions
CASTEP input files are compatible with CASTEP version 8.0 and later. For information on how to obtain a copy of CASTEP visit: http://www.castep.org -- The LTE research code was originally written by Neil Drummond and has been modified by Jonathan Lloyd-Williams and Bartomeu Monserrat. For further information, email jhl50 at cam dot ac dot uk -- The CAESAR research code was written by Bartomeu Monserrat. For further information, email bm418 at cam dot ac dot uk
Publisher
University of Cambridge
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Except where otherwised noted, this item's license is described as Attribution-ShareAlike 2.0 UK: England & Wales
Sponsorship
This work was supported by the EPSRC [grant numbers EP/J017639/1 and EP/K013564/1].