Computational Photophysics - Publications
Only publications from Innsbruck are shown below.
131. G. Schöpfer, S. Bergmeister, M. Ončák, I. Stromberg, M. Mahmoodi-Darian, P. Scheier, O. Echt, E. Gruber: Doubly charged dimers and trimers of heavy noble gases. Phys. Chem. Chem. Phys., accepted. DOI: 10.1039/D4CP00465E
130. M. Salzburger, M. Hütter, C. van der Linde, M. Ončák, M. K. Beyer: Master equation modelling of blackbody infrared radiative dissociation (BIRD) of hydrated peroxycarbonate radical anions. J. Chem. Phys. 160, 134304 (2024). DOI: 10.1063/5.0200253
129. J. C. Hartmann, S. J. Madlener, C. van der Linde, M. Ončák, M. K. Beyer: Magic Cluster Sizes of Cationic and Anionic Sodium Chloride Clusters Explained by Statistical Modeling of the Complete Phase Space. Phys. Chem. Chem. Phys., 26, 10904-10918 (2024). DOI: 10.1039/D4CP00357H
128. M. Meta, M. E. Huber, M. Birk, M. Wedele, M. Ončák, J. Meyer: Dynamics of carbene formation in the reaction of methane with the tantalum cation in the gas phase. Faraday Disc., accepted.
127. K. Li, J. Ďurana, B. Kocábková, A. Pysanenko, Y. Yan, M. Ončák, M. Fárník, J. Lengyel: Hydrated Formic Acid Clusters and their Interaction with Electrons. ChemPhysChem, accepted. DOI: 10.1002/cphc.202400071
126. M. E. Huber, T. W. R. Lewis, M. Meta, S. G. Ard, Y. Liu, B. C. Sweeny, H. Guo, M. Ončák, N. S. Shuman, J. Meyer: Ta+ and Nb+ + CO2: Intersystem crossing in ion-molecule reactions. Phys. Chem. Chem. Phys., 26, 8670-8680 (2024). DOI: 10.1039/D3CP05549C
125. M. Juanes, S. Jin, R. Saragi, C. van der Linde, A. Ebenbichler, N. Przybilla, M. Ončák, M. K. Beyer: Iron Complexes as Potential Carriers of Diffuse Interstellar Bands: The Photodissociation Spectrum of Fe+(H2O) at Optical Wavelengths. J. Phys. Chem. A, 128, 1306–1312 (2024). DOI: 10.1021/acs.jpca.4c00148
124. B. Kocábková, J. Ďurana, J. Rakovský, A. Pysanenko, J. Fedor, M. Ončák, M. Fárník: Electron-triggered processes in halogenated carboxylates: Dissociation pathways in CF3COCl molecule and its clusters. Phys. Chem. Chem. Phys., 26, 5640-5648 (2024). DOI: 10.1039/D3CP05387C
123. S. Bergmeister, L. Ganner, M. Ončák, E. Gruber: Gas-Phase Electronic Structure of Phthalocyanine Ions: A Study of Symmetry and Solvation Effects. Adv. Sci., accepted. DOI: 10.1002/advs.202307816
122. M. Kappe, A. Schiller, E. Gruber, D. Jank, M. Gatt, G. Schöpfer, M. Ončák, A. Ellis, P. Scheier: Spectroscopy of C60+ and C120+ in the mid-infrared. J. Chem. Phys., 159, 204302 (2023). DOI: 10.1063/5.0176407.
121. T. Schwab, E. Muchová, K. Aicher, T. Berger, M. Ončák, O. Diwald: Oxygen Radicals Entrapped between MgO Nanocrystals: Formation, Spectroscopic Fingerprints and Reactivity towards Water. J. Phys. Chem. C, 48, 23332 (2023). DOI: 10.1021/acs.jpcc.3c06091
120. N. K. Bersenkowitsch, S. Madlener, J. Heller, C. van der Linde, M. Ončák, M. K. Beyer: Spectroscopy of Cluster Aerosol Models: IR and UV Spectra of Hydrated Glyoxylate with and without Sea Salt. Env. Science: Atmos., 3, 1396 (2023). DOI: 10.1039/D3EA00039G
119. A. Ayasli, A. Khan, T. Michaelsen, T. Gstir, M. Ončák, R. Wester: Imaging frontside and backside attack in radical ion-molecule reactive scattering. J. Phys. Chem. A, 127, 5565 (2023). DOI: 10.1021/acs.jpca.3c02856
118. M. Meta, M. Huber, T. Michaelsen, A. Ayasli, M. Ončák, R. Wester, J. Meyer: Dynamics of the Oxygen Atom Transfer Reaction between Carbon Dioxide and the Tantalum Cation. J. Phys. Chem. Lett., 14, 5524 (2023). 10.1021/acs.jpclett.3c01078
117. M. G. Münst, E. Barwa, M. Ončák, M. K. Beyer: Proton Transfer Reactions from N2H+ and ArH+ to Small Molecules. Isr. J. Chem., 63, e202300064 (2023). DOI: 10.1002/ijch.202300064
116. M. Saqib, F. Izadi, L. U. Isierhienrhien, M. Ončák, S. Denifl: Decomposition of triazole and 3-nitrotriazole upon low-energy electron attachment. Phys. Chem. Chem. Phys., 25, 13892 (2023). DOI: 10.1039/D3CP01162C
115. M. Salzburger, R. Saragi, F. Wensink, E. Cunningham, M. K. Beyer, J. Bakker, M. Ončák, C. van der Linde: Carbon Dioxide and Water Activation by Niobium Trioxide Anions in the Gas Phase. J. Phys. Chem. A, 127, 3402 (2023). DOI: 10.1021/acs.jpca.3c01394
114. Concept Article: M. Ončák, C.-K. Siu, C. van der Linde, W. K. Tang, M. K. Beyer: Thermally Activated vs. Photochemical Hydrogen Evolution Reactions – a Tale of Three Metals. Chem. Eur. J., 29, e202203590 (2023). DOI: 10.1002/chem.202203590
113. Account & Perspective: C. van der Linde, M. Ončák, E. Cunningham, W. K. Tang, C.-K. Siu, M. K. Beyer: Surface or internal hydration – does it really matter? J. Am. Soc. Mass Spectrom., 34, 337–354 (2023). DOI: 10.1021/jasms.2c00290
112. J. Ameixa, E. Arthur-Baidoo, J. Pereira-da-Silva, M. Ončák, J. C. Ruivo, M. T. do N. Varella, F. Ferreira da Silva, S. Denifl: Parent Anion Radical Formation in Coenzyme Q0: Breaking Ubiquinone Family Rules. Comp. Struct. Biotech. J., 21, 346-353 (2023). DOI: 10.1016/j.csbj.2022.12.011
111. Hot Topic: CO2. J. Lengyel, N. Levin, M. Ončák, K. Jakob, M. Tschurl, U. Heiz: Direct Coupling of Methane and Carbon Dioxide on Tantalum Cluster Cations. Chem. Eur. J., 29, e202203259 (2023). DOI: 10.1002/chem.202203259
110. A. Khan, A. Ayasli, T. Michaelsen, T. Gstir, M. Ončák, R. Wester: Imaging the Atomistic Dynamics of Single Proton Transfer and Combined Hydrogen/Proton Transfer in the O– + CH3I Reaction J. Phys. Chem. A, 126, 9408-9413 (2022). DOI: 10.1021/acs.jpca.2c06887
109. M. Salzburger, M. Ončák, C. van der Linde, M. K. Beyer: A simplified multiple-well approach for the master equation modelling of blackbody infrared radiative dissociation (BIRD) of hydrated carbonate radical anions. J. Am. Chem. Soc., 144, 21485-21493 (2022). DOI: 10.1021/jacs.2c07060.
108. HOT PCCP Article: M. Kappe, A. Schiller, S. A. Krasnokutski, M. Ončák, P. Scheier, E. M. Cunningham: Electronic spectroscopy of cationic adamantane clusters and dehydrogenated adamantane in helium droplets. Phys. Chem. Chem. Phys. 24, 23142-23151 (2022). DOI: 10.1039/D2CP03523E
107. E. Arthur-Baidoo, M. Ončák, S. Denifl. Electron Attachment to Fluorodeoxyglucose: Dissociation Dynamics in a Molecule of Near-Zero Electron Affinity. J. Chem. Phys. 157, 074301 (2022). DOI: 10.1063/5.0101726
106. M. Pritzi, T. F. Pascher, M.-L. Grutza, P. Kurz, M. Ončák, M. K. Beyer. Decomposition of Halogenated Molybdenum Sulfide Dianions [Mo3S7X6]2– (X = Cl, Br, I). J. Am. Soc. Mass Spectrom., 33, 1753–1760 (2022). DOI: 10.1021/jasms.2c00162
105. E. Arthur-Baidoo, G. Schöpfer, M. Ončák, L. Chomicz-Mańka, J. Rak, S. Denifl. Electron Attachment to 5-Fluorouracil: The Role of Hydrogen Fluoride in Dissociation Chemistry. Int. J. Mol. Sci. 23, 8325 (2022). DOI: 10.3390/ijms23158325
104. M. Pritzi, T. F. Pascher, M.-L. Grutza, P. Kurz, M. Ončák, M. K. Beyer. Rearrangement and Decomposition Pathways of Bare and Hydrogenated Molybdenum Oxysulfides in the Gas Phase. Phys. Chem. Chem. Phys., 24, 16576-16585 (2022). DOI: 10.1039/D2CP01189A
103. S. Jin, J. Heller, C. van der Linde, M. Ončák, M. K. Beyer. Towards Detection of FeH+ in the Interstellar Medium: Infrared Multiple Photon Dissociation Spectroscopy of Ar2FeH+. J. Phys. Chem. Lett. 13, 5867–5872 (2022). DOI: 10.1021/acs.jpclett.2c01511
102. S. Kumar, F. Izadi, M. Ončák, P. Limão-Vieira, S. Denifl: Hexachlorobenzene negative ions formation in electron attachment experiments. Phys. Chem. Chem. Phys., 24, 13335-13342 (2022). DOI: 10.1039/D2CP01360F
101. E. Arthur-Baidoo, F. Izadi, C. Guerra, G. Garcia, M. Ončák, S. Denifl: Dynamics of Ring-Cleavage Reactions in Temozolomide Induced by Low-Energy Electron Attachment. Front. Phys., 10, 880689 (2022). DOI: 10.3389/fphy.2022.880689
100. HOT PCCP Article: J. Heller, E. M. Cunningham, J. C. Hartmann, C. van der Linde, M. Ončák, M. K. Beyer: Size-Dependent H and H2 Formation by Infrared Multiple Photon Dissociation Spectroscopy of Hydrated Vanadium Cations, V+(H2O)n, n = 3–51. Phys. Chem. Chem. Phys. 24, 14699-14708 (2022). DOI: 10.1039/D2CP00833E Cover Feature
99. J. Heller, E. Cunningham, C. van der Linde, M. Ončák, M. K. Beyer: Infrared Multiple Photon Dissociation Spectroscopy Confirms Reversible Water Activation in Mn+(H2O)n, n ≤ 8. J. Phys. Chem. Lett., 13, 3269–3275 (2022). DOI: 10.1021/acs.jpclett.2c00394
98. J. Ameixa, E. Arthur-Baidoo, J. Pereira-da-Silva, J. C. Ruivo, M. T. do N. Varella, M. K. Beyer, M. Ončák, F. Ferreira da Silva, S. Denifl: Formation of temporary negative ions and their subsequent fragmentation upon electron attachment to CoQ0 and CoQ0H2. ChemPhysChem, 23, e202100834 (2022). DOI: 10.1002/cphc.202100834. Cover Feature; Cover Profile
97. E. Gruber, S. Kollotzek, S. Bergmeister, F. Zappa, M. Ončák, P. Scheier, O. Echt: Phenanthrene: Establishing lower and upper bounds to the binding energy of a very weakly bound anion. Phys. Chem. Chem. Phys., 24, 5138-5143 (2022). DOI: 10.1039/d1cp04755h.
96. Hot Paper: J. Heller, T. F. Pascher, C. van der Linde, M. Ončák, M. K. Beyer: Photochemical Hydrogen Evolution at Metal Centers Probed with Hydrated Aluminum Cations, Al+(H2O)n, n = 1–10, Chem. Eur. J., 27, 16367-16376 (2021). DOI: 10.1002/chem.202103289
95. P. Ziegler, A. Pelc, E. Arthur-Baidoo, J. Ameixa, M. Ončák, S. Denifl: Negative ion formation and fragmentation upon dissociative electron attachment to the nicotinamide molecule, RSC Advances, 11, 32425-32434 (2021). DOI: 10.1039/D1RA06083J
94. Emerging Investigators Themed Issue: J. Heller, T. F. Pascher, D. Muß, C. van der Linde, M. K. Beyer, M. Ončák: Photochemistry and UV/Vis Spectroscopy of Hydrated Vanadium Cations, V+(H2O)n, n = 1–41, a Model System for Photochemical Hydrogen Evolution. Phys. Chem. Chem. Phys., 23, 22251-22262 (2021). DOI: 10.1039/D1CP02382A
93. E. M. Cunningham, T. Taxer, J. Heller, M. Ončák, C. van der Linde, M. K. Beyer: Asymmetric solvation of the zinc dimer cation revealed by infrared multiple photon dissociation spectroscopy of Zn2+(H2O)n (n = 1–20). Int. J. Mol. Sci., 22, 6026 (2021). DOI: 10.3390/ijms22116026
92. M. Ončák, R. Ćosić, R. Kalus: Modeling of photoabsorption spectra of small helium cluster cations through ab initio and semi-empirical approaches. A comparative study. Chem. Phys, 549, 111261 (2021). DOI: 10.1016/j.chemphys.2021.111261
91. VIP Very Important Paper: J. Heller, W. K. Tang, E. M. Cunningham, E. G. Demissie, C. van der Linde, W. K. Lam, M. Ončák, C.-K. Siu, M. K. Beyer: Getting Ready for the Hydrogen Evolution Reaction: The Infrared Spectrum of Hydrated Aluminum Hydride-Hydroxide HAlOH+(H2O)n-1, n = 9-14. Angew. Chem. 133, 16994-16999 (2021); DOI: 10.1002/ange.202105166 ; Angew. Chem. Int. Ed. 60, 16858-16863 (2021); DOI: 10.1002/anie.202105166
90. S. Albertini, S. Bergmeister, F. Laimer, P. Martini, E. Gruber, F. Zappa, M. Ončák, P. Scheier, O. Echt: SF6+: Stabilizing Transient Ions in Helium Nanodroplets. J. Phys. Chem. Lett., 12, 4112−4117 (2021), DOI: 10.1021/acs.jpclett.1c01024. Short note on c&en.
89. K. Geistlinger, F. Dahlmann, T. Michaelsen, M. Ončák, E. Endres, R. Wester: Multiple helium tagging and OH vibrational spectroscopy of cold protonated glycine ions. J. Mol. Spec., 379 , 111479 (2021), DOI: 10.1016/j.jms.2021.111479.
88. Hot Paper: M. S. Sammon, M. Biewend, P. Michael, S. Schirra M. Ončák, W. H. Binder, M. K. Beyer: Activation of a Copper Biscarbene Mechano-Catalyst Using Single-Molecule Force Spectroscopy Supported by Quantum Chemical Calculations. Chem. Eur. J. 27, 8723-8729 (2021). DOI: 10.1002/chem.202100555 ; Cover Feature DOI: 10.1002/chem.202101683
87. T. F. Pascher, M. Ončák, C. van der Linde, M. K. Beyer: Spectroscopy and Photochemistry of Copper Nitrate Clusters. Phys. Chem. Chem. Phys., 23, 9911-9920 (2021). DOI: 10.1039/D1CP00629K
86. E. Arthur-Baidoo, J. Ameixa, M. Ončák, S. Denifl: Ring-Selective Fragmentation in the Tirapazamine Molecule upon
Low-Energy Electron Attachment. Int. J. Mol. Sci., 22, 3159 (2021). DOI: 10.3390/ijms22063159
85. A. Baloglou, M. Pritzi, T. F. Pascher, J. C. Hartmann, M.-L. Grutza, M. Ončák, P. Kurz, M. K. Beyer: Proton Transfer Reactivity of Molybdenum Oxysulfide Dianions [Mo2O2S6]2– and [Mo2O2S5]2–: The Role of Coulomb Barriers. Int. J. Mass Spec., 464, 116558 (2021). DOI: 10.1016/j.ijms.2021.116558
84. S. Albertini, P. Martini, A. Schiller, H. Schöbel, E. Ghavidel, M. Ončák, O. Echt, P. Scheier: Electronic transitions in Rb2+ dimers solvated in helium. Theor. Chem. Acc., 140, 29 (2021). DOI: 10.1007/s00214-021-02728-x
83. A. Pysanenko, K. Grygoryeva, J. Kočišek, R. Kumar T. P., J. Fedor, M. Ončák, M. Fárník: Stability of Pyruvic Acid Clusters upon Slow Electron Attachment. Phys. Chem. Chem. Phys., 23, 4317-4325 (2021). DOI: 10.1039/D0CP06464E
82. M. Münst, M. Ončák, M. K. Beyer, C. van der Linde: Infrared Spectroscopy of CO3●-(H2O)1,2 and CO4●-(H2O)1,2. J. Chem. Phys., 154, 084301 (2021). DOI: 10.1063/5.0038280
81. E. M. Cunningham, T. Taxer, J. Heller, M. Ončák, C. van der Linde, M. K. Beyer: Microsolvation of Zn Cations: Infrared Multiple Photon Dissociation Spectroscopy of Zn+(H2O)n (n = 2–35). Phys. Chem. Chem. Phys., 23, 3627-3636 (2021). DOI: 10.1039/D0CP06112C.
80. B. Bastian, T. Michaelsen, M. Ončák, J. Meyer, R. Wester: Suppression of low product kinetic energies in reactions of FHO- and Cl-(H2O) with CH3I, Int. J. Mass. Spectrom., 462, 116526 (2021). DOI: 10.1016/j.ijms.2021.116526.
79. VIP Very Important Paper: A. Baloglou, M. Plattner, M. Ončák, M.-L. Grutza, P. Kurz, M. K. Beyer: [Mo3S13]2– as a Model System for Hydrogen Evolution Catalysis by MoSx: Probing Protonation Sites in the Gas Phase by Infrared Multiple Photon Dissociation Spectroscopy. Angew. Chem. Int. Ed., 60, 5074-5077 (2021). DOI: 10.1002/anie.202014449; 10.1002/ange.202014449
78. F. Hechenberger, S. Kollotzek, L. Ballauf, F. Duensing, M. Ončák, Z. Herman, P. Scheier: Formation of HCN+ in collisions of N+ and N2+ with a self-assembled propanethiol surface on gold. Phys. Chem. Chem. Phys., 23, 7777-7782 (2021). DOI: 10.1039/D0CP04164E
77. M. Saqib, E. Arthur-Baidoo, M. Ončák, S. Denifl: Electron Attachment Studies with the Potential Radiosensitizer 2-Nitrofuran. Int. J. Mol. Sci., 21, 8906 (2020). DOI: 10.3390/ijms21238906
76. T. F. Pascher, M. Ončák, C. van der Linde, M. K. Beyer: Infrared Multiple Photon Dissociation Spectroscopy of Anionic Copper Formate Clusters. J. Chem. Phys., 153, 184301 (2020). DOI: 10.1063/5.0030034
75. F. J. Wensink, M. G. Münst, J. Heller, M. Ončák, J. M. Bakker, C. van der Linde: IR multiple photon dissociation spectroscopy of MO2+ (M = V, Nb, Ta). J. Chem. Phys, 153, 171101 (2020). DOI: 10.1063/5.0024675
74. L. Tiefenthaler, M. Ončák, S. Kollotzek, J. Kočišek, P. Scheier: Dissociation of Valine Cluster Cations. J. Phys. Chem. A, 124, 8439-8445 (2020). DOI: acs.jpca.0c07208
73. T. Schwab, M. Niedermaier, G. A. Zickler, M. Ončák, O. Diwald: Isolated Cobalt Ions Embedded in Magnesium Oxide Nanostructures: Spectroscopic Properties and Redox Activity. Chem. Eur. J., 26, 16049-16058 (2020). DOI: chem.202002817
72. T. F. Pascher, E. Barwa, C. van der Linde, M. K. Beyer, M. Ončák: Photochemical Activation of Carbon Dioxide in Mg+(CO2)(H2O)0,1. Theor. Chem. Acc. 139, 127 (2020). DOI: 10.1007/s00214-020-02640-w
71. Hot Paper: E. Arthur-Baidoo, J. Ameixa, P. Ziegler, F. Ferreira da Silva, M. Ončák, S. Denifl: Reactions in tirapazamine induced by the attachment of low‐energy electrons: Dissociation versus roaming of OH. Angew Chem Int. Ed., 59, 17177-17182 (2020). DOI: 10.1002/anie.202006675
70. N. K. Bersenkowitsch, M. Ončák, J. Heller, T. Pascher, C. van der Linde, M. K. Beyer: Evidence for lactone formation during infrared multiple photon dissociation spectroscopy of bromoalkanoate doped salt clusters. Phys. Chem. Chem. Phys., 22, 12028-12038 (2020). DOI: 10.1039/d0cp00272k
69. J. Lengyel, M. Ončák, M. K. Beyer: Chemistry of NOx and HNO3 Molecules with Gas‐Phase Hydrated O•− and OH− Ions. Chem. Eur. J., 26, 7861-7868 (2020). DOI: 10.1002/chem.202000322
68. T. F. Pascher, M. Ončák, C. van der Linde, M. K. Beyer: UV/VIS spectroscopy of Copper Formate Clusters: Insight into Metal-Ligand Photochemistry. Chem. Eur. J., 26, 8286-8295 (2020). DOI: 10.1002/chem.202000280
67. E. Barwa, T. F. Pascher, M. Ončák, C. van der Linde, M. K. Beyer: Carbon Dioxide Activation at Metal Centers: Evolution of Charge Transfer from Mg+ to CO2 in [MgCO2(H2O)n]+, n = 0–8. Angew. Chem. Int. Ed. 59, 7467-7471 (2020). DOI: 10.1002/anie.202001292; Angew. Chem. 132, 7537-7541 (2020). DOI: 10.1002/ange.202001292.
66. Editor's Pick: B. Bastian, T. Michaelsen, M. Ončák, J. Meyer, R. Wester: F−(H2O) + CH3I Ligand Exchange Reaction Dynamics Chin. J. Chem. Phys., 33, 210-216 (2020). DOI: 10.1063/1674-0068/cjcp2002018.
65. B. Bastian, T. Michaelsen, L. Li, M. Ončák, J. Meyer, D. H. Zhang, R. Wester: Imaging Reaction Dynamics of F–(H2O) and Cl–(H2O) with CH3I J. Phys. Chem. A, 124, 1929–1939 (2020). DOI: 10.1021/acs.jpca.0c00098.
64. VIP Very Important Paper: E. Barwa, M. Ončák, T. F. Pascher, A. Herburger, C. van der Linde, M. K. Beyer: Infrared Multiple Photon Dissociation Spectroscopy of Hydrated Cobalt Anions Doped with Carbon Dioxide CoCO2(H2O)n−, n = 1−10, in the C-O stretch region. Chem. Eur. J. 26, 1074-1081 (2020). DOI: 10.1002/chem.201904182
63. T. F. Pascher, M. Ončák, C. van der Linde, M. K. Beyer: Decomposition of Copper Formate Clusters: Insight into Elementary Steps of Calcination and Carbon Dioxide Activation. ChemistryOpen 8, 1453-1459 (2019). DOI: 10.1002/open.201900282
62. A. Herburger, E. Barwa, M. Ončák, J. Heller, C. van der Linde, D. M. Neumark, M. K. Beyer: Probing the Structural Evolution of the Hydrated Electron in Water Cluster Anions (H2O)n–, n ≤ 200, by Electronic Absorption Spectroscopy. J. Am. Chem. Soc. 141, 18000-18003 (2019). DOI: 10.1021/jacs.9b10347
61. PCCP Editor's Choice: L. Kranabetter, N. K. Bersenkowitsch, P. Martini, M. Gatchell, M. Kuhn, F. Laimer, A. Schiller, M. K. Beyer, M. Ončák, Paul Scheier: Considerable Matrix Shift in the Electronic Transitions of Helium-Solvated Cesium Dimer Cation Cs2Hen+. Phys. Chem. Chem. Phys. 21, 25362-25368 (2019). DOI: 10.1039/c9cp04790e
60. M. Plattner, A. Baloglou, M. Ončák, C. van der Linde, M. K. Beyer: Structural Properties of Gas-Phase Molybdenum Oxide Clusters [Mo4O13]2−, [HMo4O13]−, and [CH3Mo4O13]− Studied by Collision-Induced Dissociation. J. Am. Soc. Mass Spectrom. 30, 1946-1955 (2019). DOI: 10.1007/s13361-019-02294-4
59. F. Gámez, A. Pysanenko, M. Fárník, M. Ončák: 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. Phys. Chem. Chem. Phys. 21, 19201-19208 (2019), DOI: 10.1039/C9CP03279G
58. M. Ončák, R. Meißner, E. Arthur-Baidoo, S. Denifl, T. F. M. Luxford, A. Pysanenko, M. Fárník, J. Pinkas, J. Kočišek: Ring Formation and Hydration Effects in Electron Attachment to Misonidazole. Int. J. Mol. Sci. 20(18), 4383 (2019). DOI: 10.3390/ijms20184383
57. A. Herburger, M. Ončák, C.-K. Siu, E. G. Demissie, J. Heller, W. K. Tang, M. K. Beyer: Infrared Spectroscopy of Size-selected Hydrated Carbon Dioxide Radical Anions CO2•-(H2O)n (n = 2–61) in the C-O Stretch Region. Chem. Eur. J. 25, 10165-10171 (2019). DOI: 10.1002/chem.201901650
56. T. F. Pascher, M. Ončák, C. van der Linde, M. K. Beyer: Release of Formic Acid from Copper Formate: Hydride, Proton Coupled Electron and Hydrogen Atom Transfer All Play their Role. ChemPhysChem 20, 1420-1424 (2019). DOI: 10.1002/cphc.201900095
55. T. Taxer, M. Ončák, E. Barwa, C. van der Linde, M. K. Beyer: Electronic Spectroscopy and Nanocalorimetry of Hydrated Magnesium Ions [Mg(H2O)n]+, n = 20-70: Spontaneous Formation of a Hydrated Electron? Faraday Discuss. 217, 584-600 (2019). DOI: 10.1039/C8FD00204E
54. K. Grygoryeva, M. Ončák, A. Pysanenko, M. Fárník: Pyruvic acid proton and hydrogen transfer reactions in clusters. Phys. Chem. Chem. Phys. 21, 8221-8227, (2019). DOI: 10.1039/c8cp07008c
53. E. Barwa, M. Ončák, T. F. Pascher, T. Taxer, C. van der Linde, M. K. Beyer: CO2/O2 Exchange in Magnesium-Water Clusters Mg+(H2O)n. J. Phys. Chem. A 123, 73-81 (2019). DOI: 10.1021/acs.jpca.8b10530
52. A. Baloglou, M. Ončák, M.-L. Grutza, C. van der Linde, P. Kurz, M. K. Beyer: Structural Properties of Gas Phase Molybdenum Sulfide Clusters [Mo3S13]2-, [HMo3S13]-, and [H3Mo3S13]+ as Model Systems of a Promising Hydrogen Evolution Catalyst. J. Phys. Chem. C 123, 8177-8186 (2019). DOI: 10.1021/acs.jpcc.8b08324
51. A. Herburger, M. Ončák, E. Barwa, C. van der Linde, M. K. Beyer: Carbon-Carbon Bond Formation in the Reaction of Hydrated Carbon Dioxide Radical Anions with 3-Butyn-1-ol. Int. J. Mass Spectrom. 435, 101-106 (2019). DOI: 10.1016/j.ijms.2018.10.019
50. J. Heller, M. Ončák, N. K. Bersenkowitsch, C. van der Linde, M. K. Beyer: Infrared Multiple Photon Dissociation of Cesium Iodide Clusters Doped with Mono-, Di- and Triglycine. Eur. J. Mass Spectrom. 25, 122-132 (2019). DOI: 10.1177/1469066718803307
49. J. Lengyel, M. Ončák, M. Fárník: Role of Water in Chemistry: Molecular Point of View (in Czech). Chem. Listy 112, 819 (2018). Link
48. M. Ončák, T. Taxer, E. Barwa, C. van der Linde, M. K. Beyer: Photochemistry and Spectroscopy of Small Hydrated Magnesium Clusters Mg+(H2O)n, n = 1–5. J. Chem. Phys. 149, 044309 (2018). DOI: 10.1063/1.5037401
47. VIP Very Important Paper, Young Chemist Issue: N. K. Bersenkowitsch, M. Ončák, J. Heller, C. van der Linde, M. K. Beyer: Photodissociation of Sodium Iodide Clusters Doped with Small Hydrocarbons. Chem. Eur. J. 24, 12433-12443 (2018). DOI: 10.1002/chem.201803017
46. N. K. Bersenkowitsch, M. Ončák, C. van der Linde, A. Herburger, M. K. Beyer: Photochemistry of glyoxylate embedded in sodium chloride clusters, a laboratory model for tropospheric sea-salt aerosols. Phys. Chem. Chem. Phys. 20, 8143-8151 (2018). DOI: 10.1039/c8cp00399h
45. A. Kaiser, J. Postler, M. Ončák, M. Kuhn, M. Renzler, S. Spieler, M. Simpson, M. Gatchell, M. K. Beyer, R. Wester, F. Gianturco, P. Scheier: Isomeric Broadening of C60+ Electronic Excitation in Helium Droplets: Experiments Meet Theory. J. Phys. Chem. Lett. 9, 1237-1242 (2018). DOI: 10.1021/acs.jpclett.8b00150
44. A. Baloglou, M. Ončák, C. van der Linde, M. K. Beyer: Gas-Phase Reactivity Studies of Small Molybdenum Cluster Ions with Dimethyl Disulfide. Top. Catal. 61, 20-27 (2018). DOI: 10.1007/s11244-017-0864-3
43. J. Lengyel, M. Ončák, A. Herburger, C. van der Linde, M. K. Beyer: Infrared spectroscopy of O˙− and OH− in water clusters: evidence for fast interconversion between O˙− and OH˙OH−. Phys. Chem. Chem. Phys. 19, 25346-25351 (2017). DOI: 10.1039/c7cp04577h
42. M. S. Sammon, M. Ončák, M. K. Beyer: Theoretical simulation of the infrared signature of mechanically stressed polymer solids. Beilstein J. Org. Chem. 13, 1710-1716 (2017). DOI: 10.3762/bjoc.13.165
41. J. Lengyel, M. Ončák, J. Fedor, J. Kočišek, A. Pysanenko, M. K. Beyer, M. Fárník: Electron-triggered chemistry in HNO3/H2O complexes. Phys. Chem. Chem. Phys. 19, 11753-11758 (2017). DOI: 10.1039/c7cp01205e
Editorial Materials:
1. M. Ahmed et al.: Controlling internal degrees: general discussion. Faraday Discuss. 217, 138-171 (2019). DOI: 10.1039/C9FD90032B