Published articles

Published articles 1 records found  Search took 0.00 seconds. 
1.
11 p, 9.8 MB Ab initio study of electron-phonon coupling in rubrene / Ordejón Rontomé, Pablo (Institut Català de Nanociència i Nanotecnologia) ; Boskovic, Desanka (Institut Català de Nanociència i Nanotecnologia) ; Panhans, Michel (Technische Universität Dresden) ; Ortmann, Frank (Technische Universität Dresden)
The use of ab initio methods for accurate simulations of electronic, phononic, and electron-phonon properties of molecular materials such as organic crystals is a challenge that is often tackled stepwise based on molecular properties calculated in gas phase and perturbatively treated parameters relevant for solid phases. [...]
2017 - 10.1103/PhysRevB.96.035202
Physical Review B, Vol. 96, Núm. 3 (July 2017) , art. 035202  

Interested in being notified about new results for this query?
Set up a personal email alert or subscribe to the RSS feed.