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Physical Chemistry Chemical Physics : PCCP|August 14, 2013
Quantification of intramolecular cooperativity in polynuclear spin crossover Fe(II) complexes by density functional theory calculationsSergej Rackwitz, Wim Klopper, Volker Schünemann, et al.Journal of the American Chemical Society|July 29, 2010
Synthesis of a pentasilapropellane. Exploring the nature of a stretched silicon-silicon bond in a nonclassical moleculeDominik Nied, Ralf Köppe, Wim Klopper, et al.Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|January 13, 2009
Ab initio study of the interactions between CO(2) and N-containing organic heterocyclesKonstantinos D Vogiatzis, Andreas Mavrandonakis, Wim Klopper, et al.The Journal of Physical Chemistry. A|July 10, 2009
Magnetically induced current densities in aromatic, antiaromatic, homoaromatic, and nonaromatic hydrocarbonsHeike Fliegl, Dage Sundholm, Stefan Taubert, et al.Physical Chemistry Chemical Physics : PCCP|February 26, 2015
Activation enthalpies and entropies of the atropisomerization of substituted butyl-bridged biphenylsAngela Bihlmeier, Jürgen Rotzler, Michel Rickhaus, et al.Inorganic Chemistry|April 2, 2015
[(Pb6I8){Mn(CO)5}6](2-): an octahedral (M6X8)-like cluster with inverted bondingSilke Wolf, Kevin Reiter, Florian Weigend, et al.The Journal of Organic Chemistry|July 16, 2013
ortho-Perfluoroalkylation and ethoxycarbonyldifluoromethylation of aromatic triazenesAndreas Hafner, Angela Bihlmeier, Martin Nieger, et al.Inorganic Chemistry|August 27, 2020
[BMIm]2[Mn(CO)3(GeI3)3]: Carbonyl Compound with an {MnGe3} Cluster UnitSilke Wolf, Shangxin Wei, Wim Klopper, et al.Journal of Computational Chemistry|July 28, 2011
Acceleration of self-consistent-field convergence by combining conventional diagonalization and a diagonalization-free procedureAlexander Baldes, Wim Klopper, Ján Simunek, et al.Physical Chemistry Chemical Physics : PCCP|March 20, 2008
Self-consistent treatment of spin-orbit interactions with efficient Hartree-Fock and density functional methodsMarkus K Armbruster, Florian Weigend, Christoph van Wüllen, et al.Pageof 20