Publications by authors named "Thorsten Metzroth"

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Reversible hydrogen bond network dynamics: molecular dynamics simulations of calix[4]arene-catenanes.
Thomas Schlesier, Thorsten Metzroth, Andreas Janshoff, Jürgen Gauss, Gregor Diezemann

J Phys Chem B· May 2011

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Mechanically interlocked calix[4]arene dimers display reversible bond breakage under force.
Matthias Janke, Yuliya Rudzevich, Olena Molokanova, Thorsten Metzroth, Ingo Mey

Nat Nanotechnol· April 2009

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Parallel Calculation of CCSD and CCSD(T) Analytic First and Second Derivatives.
Michael E Harding, Thorsten Metzroth, Jürgen Gauss, Alexander A Auer

J Chem Theory Comput· January 2008

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Helical packing of discotic hexaphenyl hexa-peri-hexabenzocoronenes: theory and experiment.
Wojciech Pisula, Zeljko Tomović, Mark D Watson, Klaus Müllen, Jörg Kussmann, Thorsten Metzroth

J Phys Chem B· July 2007

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Low-pressure pyrolysis of tBu2SO: synthesis and IR spectroscopic detection of HSOH.
Helmut Beckers, Simone Esser, Thorsten Metzroth, Markus Behnke, Helge Willner

Chemistry· January 2006

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Determining the geometry of hydrogen bonds in solids with picometer accuracy by quantum-chemical calculations and NMR spectroscopy.
Martin Schulz-Dobrick, Thorsten Metzroth, Hans Wolfgang Spiess, Jürgen Gauss, Ingo Schnell

Chemphyschem· February 2005

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