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1579 Publications visible to you, out of a total of 1579
Hydrodynamic moving-mesh simulations of the common envelope phase in binary stellar systems

Abstract

Not specified

Authors: Sebastian T. Ohlmann, Friedrich K. Röpke, Rüdiger Pakmor, Volker Springel

Date Published: 2016

Publication Type: Journal

Type Ia supernovae from violent mergers of carbon-oxygen white dwarfs: polarization signatures

Abstract

Not specified

Authors: M. Bulla, S. A. Sim, R. Pakmor, M. Kromer, S. Taubenberger, F. K. Röpke, W. Hillebrandt, I. R. Seitenzahl

Date Published: 2016

Publication Type: Journal

Quantitative spectral analysis of the sdB star HD 188112: A helium-core white dwarf progenitor

Abstract

Not specified

Authors: M. Latour, U. Heber, A. Irrgang, V. Schaffenroth, S. Geier, W. Hillebrandt, F. K. Röpke, S. Taubenberger, M. Kromer, M. Fink

Date Published: 2016

Publication Type: Journal

Parallel Computing: On the Road to Exascale, Proceedings of the International Conference on Parallel Computing, ParCo 2015, 1-4 September 2015, Edinburgh, Scotland, UK

Abstract

Not specified

Authors: Gerhard R. Joubert, Hugh Leather, Mark Parsons, Frans J. Peters, Mark Sawyer

Date Published: 2016

Publication Type: Proceedings

Extreme Scale-out SuperMUC Phase 2 - lessons learned

Abstract

Not specified

Authors: Nicolay Hammer, Ferdinand Jamitzky, Helmut Satzger, Momme Allalen, Alexander Block, Anupam Karmakar, Matthias Brehm, Reinhold Bader, Luigi Iapichino, Antonio Ragagnin, Vasilios Karakasis, Dieter Kranzlmueller, Arndt Bode, Herbert Huber, Martin Kuehn, Rui Machado, Daniel Gruenewald, Philipp V. F. Edelmann, Friedrich K. Röpke, Markus Wittmann, Thomas Zeiser, Gerhard Wellein, Gerald Mathias, Magnus Schwoerer, Konstantin Lorenzen, Christoph Federrath, Ralf Kleßen, Karl-Ulrich Bamberg, Hartmut Ruhl, Florian Schornbaum, Martin Baür, Anand Nikhil, Jiaxing Qi, Harald Klimach, Hinnerk Stueben, Abhishek Deshmukh, Tobias Falkenstein, Klaus Dolag, Margarita Petkova

Date Published: 2016

Publication Type: InProceedings

Why Are sec-Alkylperoxyl Bimolecular Self-Reactions Orders of Magnitude Faster than the Analogous Reactions of tert-Alkylperoxyls? The Unanticipated Role of CH Hydrogen Bond Donation

Abstract (Expand)

High-level ab initio calculations are used to identify the mechanism of secondary (and primary) alkylperoxyl radical termination and explain why their reactions are much faster than their tertiary … counterparts. Contrary to existing literature, the decomposition of both tertiary and non-tertiary tetroxides follows the same asymmetric two-step bond cleavage pathway to form a caged intermediate of overall singlet multiplicity comprising triplet oxygen and two alkoxyl radicals. The alpha hydrogen atoms of non-tertiary species facilitate this process by forming unexpected CH⋯O hydrogen bonds to the evolving O2. For non-tertiary peroxyls, subsequent alpha hydrogen atom transfer then yields the experimentally observed non-radical products, ketone, alcohol and O2, whereas for tertiary species, this reaction is precluded and cage escape of the (unpaired) alkoxyl radicals is a likely outcome with important consequences for autoxidation.

Authors: Richmond Lee, Ganna Gryn'ova, K. U. Ingold, Michelle L. Coote

Date Published: 2016

Publication Type: Journal

Modeling and Simulation of Protein-Surface Interactions

Abstract

Not specified

Author: Musa Ozboyaci

Date Published: 2016

Publication Type: Doctoral Thesis

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