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	1.	Microhydration of caesium compounds: Cs, CsOH, CsI and Cs₂I₂ complexes with one to three H₂O molecules of nuclear safety interest. [electronic resource] by Sudolská, Mária Cantrel, Laurent Cernušák, Ivan Producer: 20141104 In: Journal of molecular modeling vol. 20 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	Ab initio calculations of molecular properties of low-lying electronic states of 2-cyclopenten-1-one--link with biological activity. [electronic resource] by Fišanová, Jana Cernušák, Ivan Kellö, Vladimír Producer: 20130312 In: Journal of molecular modeling vol. 18 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	3.	Reactivity of CHI3 with OH radicals: X-abstraction reaction pathways (X = H, I), atmospheric chemistry, and nuclear safety. [electronic resource] by Sudolská, Mária Louis, Florent Cernušák, Ivan Producer: 20150521 In: The journal of physical chemistry. A vol. 118 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	4.	On the work function of the surface Mo(0 0 1) and its temperature dependence: an ab initio molecular dynamics study. [electronic resource] by Bučko, Tomáš Novotný, Michal Černušák, Ivan Publication details: Journal of physics. Condensed matter : an Institute of Physics journal Dec 2018 In: Journal of physics. Condensed matter : an Institute of Physics journal vol. 30 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	Theoretical Study of the Reactions of H Atoms with CH [electronic resource] by Khiri, Dorra Černušák, Ivan Louis, Florent Producer: 20180919 In: The journal of physical chemistry. A vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	6.	MS-CASPT2 study of the ground and low lying states of CsH [electronic resource] by Škoviera, Ján Černušák, Ivan Louis, Florent Neogrády, Pavel Producer: 20180307 In: Journal of molecular modeling vol. 23 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	7.	A Density Functional Theory and ab Initio Investigation of the Oxidation Reaction of CO by IO Radicals. [electronic resource] by Khanniche, Sarah Louis, Florent Cantrel, Laurent Černušák, Ivan Producer: 20160803 In: The journal of physical chemistry. A vol. 120 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	8.	Toward more efficient CCSD(T) calculations of intermolecular interactions in model hydrogen-bonded and stacked dimers. [electronic resource] by Dedíková, Pavlína Pitonák, Michal Neogrády, Pavel Cernusák, Ivan Urban, Miroslav Producer: 20080924 In: The journal of physical chemistry. A vol. 112 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	9.	Caesium hydride: MS-CASPT2 potential energy curves and A [electronic resource] by Škoviera, Ján Neogrády, Pavel Louis, Florent Pitoňák, Michal Černušák, Ivan Producer: 20180608 In: The Journal of chemical physics vol. 146 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	10.	On the ground and some low-lying excited states of ScB: a multiconfigurational study. [electronic resource] by Cernusák, Ivan Dallos, Michal Lischka, Hans Müller, Thomas Uhlár, Milan Producer: 20070814 In: The Journal of chemical physics vol. 126 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	11.	Structural changes in the series of boron-carbon mixed clusters C(x)B(10-x)- (x = 3-10) upon substitution of boron by carbon. [electronic resource] by Popov, Ivan A Popov, Valery F Bozhenko, Konstantin V Černušák, Ivan Boldyrev, Alexander I Producer: 20140416 In: The Journal of chemical physics vol. 139 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	12.	Photoelectron spectroscopy and ab initio study of boron-carbon mixed clusters: CB9- and C2B8-. [electronic resource] by Galeev, Timur R Li, Wei-Li Romanescu, Constantin Cernusák, Ivan Wang, Lai-Sheng Boldyrev, Alexander I Producer: 20130528 In: The Journal of chemical physics vol. 137 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	13.	Reactivity of Hydrogen Peroxide with Br and I Atoms. [electronic resource] by Fortin, Camille Khanniche, Sarah Khiri, Dorra Fèvre-Nollet, Valérie Lebègue, Patrick Cousin, Frédéric Černušák, Ivan Louis, Florent Producer: 20180305 In: The journal of physical chemistry. A vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	14.	On the way to the highest coordination number in the planar metal-centred aromatic Ta©B10- cluster: evolution of the structures of TaB(n)- (n = 3-8). [electronic resource] by Li, Wei-Li Ivanov, Alexander S Federič, Jozef Romanescu, Constantin Černušák, Ivan Boldyrev, Alexander I Wang, Lai-Sheng Producer: 20140414 In: The Journal of chemical physics vol. 139 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)