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The Journal of Physical Chemistry. A|July 13, 2006
Separation of sigma and pi energiesAndreas M Köster, Patrizia Calaminici, Gerald Geudtner, et al.The Journal of Physical Chemistry. A|November 4, 2008
How important are temperature effects for cluster polarizabilities?Gabriel U Gamboa, Patrizia Calaminici, Gerald Geudtner, et al.Journal of Computational Chemistry|January 26, 2006
Parallelization of the deMon2k codeGerald Geudtner, Florian Janetzko, Andreas M Köster, et al.Molecules (Basel, Switzerland)|July 14, 2023
One-Pot Graphene Supported Pt3Cu Nanoparticles-From Theory towards an Effective Molecular Oxygen Reduction Reaction CatalystCarlos Daniel Galindo-Uribe, Gerald Geudtner, Patrizia Calaminici, et al.Journal of Computational Chemistry|May 13, 2004
Molecular dynamics implementation in MSINDO: study of silicon clustersNisanth N Nair, Thomas Bredow, Karl JugPhysical Chemistry Chemical Physics : PCCP|September 29, 2005
Molecular dynamics investigation of oxygen vacancy diffusion in rutileKarl Jug, Nisanth N Nair, Thomas BredowThe Journal of Physical Chemistry. B|July 21, 2006
Miscibility of zinc sulfide and zinc phosphideKarl Jug, Igor P Gloriozov, Bettina HeidbergThe Journal of Physical Chemistry. B|July 21, 2006
Toward an understanding of the formation of vanadia-titania catalystsNisanth N Nair, Thomas Bredow, Karl JugThe Journal of Organic Chemistry|October 24, 2001
On the Alternation Effect in Substituted Indolizines and Their Aza-analogsDmitriy A. Maiboroda, Eugene V. Babaev, Karl JugThe Journal of Physical Chemistry. B|March 3, 2006
Molecular dynamics study of the thermal entropy in mixed zinc chalcogenidesKarl Jug, Nisanth N Nair, Igor P GloriozovPageof 3