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List of works by Milan Ončák

A chiral dicationic [8]circulenoid: photochemical origin and facile thermal conversion into a helicene congener

scientific article published on 28 September 2012

CO2/O2 Exchange in Magnesium–Water Clusters Mg+(H2O)n

scientific article published on 19 December 2018

Can electrospray mass spectrometry quantitatively probe speciation? Hydrolysis of uranyl nitrate studied by gas-phase methods.

scientific article

Can theory quantitatively model stratospheric photolysis? Ab initio estimate of absolute absorption cross sections of ClOOCl

scientific article published on 01 November 2010

Carbon Dioxide Activation at Metal Centers: Evolution of Charge Transfer from Mg .+ to CO2 in [MgCO2 (H2 O)n ].+ , n=0-8

scientific article published on 26 February 2020

Communications: Observation of two classes of isomers of hydrated electrons in sodium-water clusters

scientific article published on 01 June 2010

Considerable matrix shift in the electronic transitions of helium-solvated cesium dimer cation Cs2He

scientific article published on 08 November 2019

Direct Observation of Triple Ions in Aqueous Solutions of Nickel(II) Sulfate: A Molecular Link Between the Gas Phase and Bulk Behavior ⬇️

scientific article published on February 3, 2011

Electron Attachment Studies with the Potential Radiosensitizer 2-Nitrofuran

scientific article published on 24 November 2020

Electron-triggered chemistry in HNO3/H2O complexes

scientific article published on 11 April 2017

Electronic spectroscopy and nanocalorimetry of hydrated magnesium ions [Mg(H2O)n]+, n = 20-70: spontaneous formation of a hydrated electron?

scientific article published on 01 July 2019

Electronic structure and physical properties of MiXi clusters (M = B, Al; X = N, P; i = 1, 2, 3): Ab initio study

scientific article published on 01 January 2008

Emergence of charge-transfer-to-solvent band in the absorption spectra of hydrogen halides on ice nanoparticles: spectroscopic evidence for acidic dissociation

scientific article published on 29 May 2008

Evidence for lactone formation during infrared multiple photon dissociation spectroscopy of bromoalkanoate doped salt clusters

scientific article published on 18 May 2020

Flexible H2O2 in Water: Electronic Structure from Photoelectron Spectroscopy and Ab Initio Calculations ⬇️

scientific article published on February 21, 2011

Formation of HCN+ in collisions of N+ and N2+ with a self-assembled propanethiol surface on gold

scientific article published on 05 October 2020

Gas-Phase Reactivity Studies of Small Molybdenum Cluster Ions with Dimethyl Disulfide

scientific article published on 27 November 2017

Gas-phase reactivities of charged platinum dimers with ammonia: A combined experimental/theoretical study

Generation and orientation of organoxenon molecule H-Xe-CCH in the gas phase.

scientific article

IR multiple photon dissociation spectroscopy of MO2 + (M = V, Nb, Ta)

scientific article published on 01 November 2020

Imaging Reaction Dynamics of F-(H2O) and Cl-(H2O) with CH3I

scientific article published on 26 February 2020

Infrared Multiple Photon Dissociation Spectroscopy of Hydrated Cobalt Anions Doped with Carbon Dioxide CoCO2 (H2 O)n - , n=1-10, in the C-O Stretch Region

scientific article published on 16 January 2020

Infrared Spectroscopy of Size-Selected Hydrated Carbon Dioxide Radical Anions CO2 .- (H2 O)n (n=2-61) in the C-O Stretch Region

scientific article published on 01 July 2019

Infrared multiple photon dissociation spectroscopy of anionic copper formate clusters

scientific article published on 01 November 2020

Infrared spectroscopy of O˙- and OH- in water clusters: evidence for fast interconversion between O˙- and OH˙OH.

scientific article published on 11 September 2017

Ionization of carboxylic acid clusters in the gas phase and on free ArN and (H2O)N nanoparticles: valeric acid as a model for small carboxylic acids

scientific article published on 22 August 2019

Isomeric Broadening of C60+ Electronic Excitation in Helium Droplets: Experiments Meet Theory.

scientific article published on 26 February 2018

Novel covalent bond in proteins: calculations on model systems question the bond stability

scientific article

On the nature and origin of dicationic, charge-separated species formed in liquid water on X-ray irradiation.

scientific article

Photochemical activation of carbon dioxide in Mg+(CO2)(H2O)0,1

scientific article published on 04 July 2020

Photochemistry and spectroscopy of small hydrated magnesium clusters Mg+(H2O)n, n = 1-5

scientific article published on 01 July 2018

Photochemistry of glyoxylate embedded in sodium chloride clusters, a laboratory model for tropospheric sea-salt aerosols

scientific article published on 8 March 2018

Photodissociation of Sodium Iodide Clusters Doped with Small Hydrocarbons

Probing the Structural Evolution of the Hydrated Electron in Water Cluster Anions (H2O)n-, n ≤ 200, by Electronic Absorption Spectroscopy

scientific article published on 29 October 2019

Pyruvic acid proton and hydrogen transfer reactions in clusters

scientific article published on 01 April 2019

Reaction mechanism of oxidation, hydroxylation, and epoxidation by hypofluorous acid: a theoretical study of unusual H-bond-assisted catalysis.

scientific article

Release of Formic Acid from Copper Formate: Hydride, Proton-Coupled Electron and Hydrogen Atom Transfer All Play their Role.

scientific article

Reversal of Hofmeister Ordering for Pairing of NH4+vs Alkylated Ammonium Cations with Halide Anions in Water

scientific article published on 01 August 2010

Ring Formation and Hydration Effects in Electron Attachment to Misonidazole

scientific article published on 06 September 2019

Simulations of light induced processes in water based on ab initio path integrals molecular dynamics. I. Photoabsorption.

scientific article published in October 2011

Simulations of light induced processes in water based on ab initio path integrals molecular dynamics. II. Photoionization ⬇️

scientific article published on October 21, 2011

Simulations of photoemission and equilibrium redox processes of ionic liquids: the role of ion pairing and long-range polarization

scientific article published on 31 May 2011

Size resolved infrared spectroscopy of Na(CH3OH)n (n = 4–7) clusters in the OH stretching region: unravelling the interaction of methanol clusters with a sodium atom and the emergence of the solvated electron ⬇️

scientific article published on January 30, 2012

Solvent-induced photostability of acetylene molecules in clusters probed by multiphoton dissociation

scientific article published on 01 July 2009

Structural Properties of Gas Phase Molybdenum Sulfide Clusters [Mo3S13]2–, [HMo3S13]−, and [H3Mo3S13]+ as Model Systems of a Promising Hydrogen Evolution Catalyst

scientific article published on 16 October 2018

Theoretical simulation of the infrared signature of mechanically stressed polymer solids

scientific article published on 17 August 2017

Theoretical study of the microhydration of mononuclear and dinuclear uranium(VI) species derived from solvolysis of uranyl nitrate in water

scientific article published on 01 September 2010

Thermal NH Bond Activation on Anionic and Cationic Platinum Clusters: Non-Predetermined Reaction Pathways Indicate Transitions to a Bulk Surface Reactivity

article

Transforming Anion Instability into Stability: Contrasting Photoionization of Three Protonation Forms of the Phosphate Ion upon Moving into Water

article

Valence ionization of water clusters: from isolated molecules to bulk

scientific article published on 01 December 2009

Water photodissociation in free ice nanoparticles at 243 nm and 193 nm

scientific article published on 25 June 2008

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