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Prof. Thomas Frauenheim

Phone:+49 421 218 62340
Email:frauenheim [at] bccms.uni-bremen.de
Room:3.27 (TAB-Building, Entry A)
Year:  
All :: 1975, ... , 2013, 2014, 2015, 2016
References
Witek, H. A.;  Chou, C. P.;  Mazur, G.;  Nishimura, Y.;  Irle, S.;  Aradi, B.;  Frauenheim, T. and Morokuma, K.
Automatized Parameterization of the Density‐functional Tight‐binding Method. II. Two‐center Integrals
Journal of the Chinese Chemical Society 63, 57-68 (2016)
Pal, S.;  Trivedi, D. J.;  Akimov, A. V.;  Aradi, B.;  Frauenheim, T. and Prezhdo, O. V.
Nonadiabatic Molecular Dynamics for Thousand Atom Systems: A Tight-Binding Approach toward PYXAID
J. Chem. Theory Comput. 12, 1436-1448 (2016)
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