Publications by authors named "Jan Dillen"

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Computational investigation of Au·H hydrogen bonds involving neutral Au N-heterocyclic carbene complexes and amphiprotic binary hydrides.
Ferdinand Groenewald, Helgard G Raubenheimer, Jan Dillen, Catharine Esterhuysen

J Mol Model· April 2019

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Steric and Electronic Effects in Gold N-Heterocyclic Carbene Complexes Revealed by Computational Analysis.
Sunel de Kock, Jan Dillen, Catharine Esterhuysen

ChemistryOpen· April 2019

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A comparison of energetic criteria to probe the stabilizing interaction resulting from a bond path between congested atoms.
Dirkie Myburgh, Stuart von Berg, Jan Dillen

J Comput Chem· October 2018

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The topology of the Coulomb potential density. A comparison with the electron density, the virial energy density, and the Ehrenfest force density.
Lizé-Mari Ferreira, Alan Eaby, Jan Dillen

J Comput Chem· December 2017

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Gold setting the "gold standard" among transition metals as a hydrogen bond acceptor - a theoretical investigation.
Ferdinand Groenewald, Helgard G Raubenheimer, Jan Dillen, Catharine Esterhuysen

Dalton Trans· April 2017

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Preparing Gold(I) for Interactions with Proton Donors: The Elusive [Au]⋅⋅⋅HO Hydrogen Bond.
Ferdinand Groenewald, Jan Dillen, Helgard G Raubenheimer, Catharine Esterhuysen

Angew Chem Int Ed Engl· January 2016

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The topology of the Ehrenfest force density revisited. A different perspective based on Slater-type orbitals.
Jan Dillen

J Comput Chem· May 2015

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On the structure and bonding of first row transition metal ozone carbonyl hydrides.
Gerhard A Venter, Helgard G Raubenheimer, Jan Dillen

J Phys Chem A· August 2007

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Deviation from tetrahedral geometry in Me(2)GeCl(2): crystal structure of a model compound and insight from ab initio calculations.
Heidi Rohwer, Jan Dillen

Inorg Chem· August 2002

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