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Inorganic Chemistry|December 9, 2003
One metal and forty nitrogens. Ab initio predictions for possible new high-energy pentazolidesMichal Straka, Pekka PyykköJournal of the American Chemical Society|September 22, 2005
Linear HThThH: a candidate for a Th-Th triple bondMichal Straka, Pekka PyykköPhysical Chemistry Chemical Physics : PCCP|May 14, 2010
Formulations of the closed-shell interactions in endohedral systemsCong Wang, Michal Straka, Pekka PyykköChemical Communications (Cambridge, England)|August 29, 2002
HgH4 and HgH6: further candidates for high-valent mercury compoundsPekka Pyykkö, Michal Straka, Michael PatzschkePhysical Chemistry Chemical Physics : PCCP|June 7, 2007
A London-type formula for the dispersion interactions of endohedral A@B systemsPekka Pyykkö, Cong Wang, Michal Straka, et al.Journal of Computational Chemistry|October 15, 2013
The RTAM electronic bibliography, version 17.0, on relativistic theory of atoms and moleculesPekka PyykköThe Journal of Physical Chemistry. A|August 28, 2014
Additive covalent radii for single-, double-, and triple-bonded molecules and tetrahedrally bonded crystals: a summaryPekka PyykköAngewandte Chemie (International Ed. in English)|September 2, 2004
Theoretical chemistry of goldPekka PyykköChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|December 6, 2018
Simple Estimates for Eutectic BehaviorPekka PyykköPageof 14