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Article
How can we make stable linear monoatomic chains? Gold-cesium binary subnanowires as an example of a charge-transfer-driven approach to alloyingSCIESCOPUS

PHYSICAL REVIEW LETTERS, vol. 98, no. 7, 2007-02-16

Article
On the microscopic interaction of para-chlorofluorobenzene with waterSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 115, no. 21, page. 10045 - 10047, 2001-12-01

Article
Dissociation chemistry of hydrogen halides in waterSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 120, no. 20, page. 9524 - 9535, 2004-05-22

Article
Ground state structures and excited state dynamics of pyrrole-water complexes: Ab initio excited state molecular dynamics simulationsSCIESCOPUS

JOURNAL OF CHEMICAL PHYSICS, vol. 128, no. 3, 2008-01-21

Article
Intercalation of Transition Metals into Stacked Benzene Rings: A Model Study of the Intercalation of Transition Metals into Bilayered GrapheneSCIESCOPUS

JOURNAL OF CHEMICAL THEORY AND COMPUTATION, vol. 8, no. 1, page. 99 - 105, 2012-01

Article
Structures, Energetics, and IR Spectra of Monohydrated Inorganic Acids: Ab initio and DFT StudySCIESCOPUS

JOURNAL OF CHEMICAL THEORY AND COMPUTATION, vol. 7, no. 10, page. 3447 - 3459, 2011-10

Article
Binary complexes of tertiary amines with phenylacetylene. Dispersion wins over electrostaticsSCIESCOPUS

PHYSICAL CHEMISTRY CHEMICAL PHYSICS, vol. 12, no. 23, page. 6150 - 6156, 2010-01

Article
Quantum-mechanical probabilistic structure of the water dimer with an excess electronSCIESCOPUS

PHYSICAL REVIEW A, vol. 59, no. 2, page. R930 - R933, 1999-02

Article
Molecular architecture using novel types of non-covalent π-interactions involving aromatic neutrals, aromatic cations and π-anionsSCIESCOPUS

CRYSTENGCOMM, vol. 15, no. 7, page. 1285 - 1288, 2013-02

Article
H-2-Binding by Neutral and Multiply Charged Titaniums: Hydrogen Storage Capacity of Titanium Mono- and DicationsSCIESCOPUS

JOURNAL OF CHEMICAL THEORY AND COMPUTATION, vol. 7, no. 4, page. 969 - 978, 2011-04

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