Publications

Journal Article (237)

1.
Journal Article
Shi, L.; Schröder, M.; Meyer, H.-D.; Peláez, D.; Wodtke, A. M.; Golibrzuch, K.; Schönemann, A.-M.; Kandratsenka, A.; Gatti, F.: Quantum and classical molecular dynamics for H atom scattering from graphene. The Journal of Chemical Physics 159, 194102 (2023)
MPG.PuRe
DOI
2.
Journal Article
Krüger, K.; Wang, Y.; Zhu, L.; Jiang, B.; Guo, H.; Wodtke, A. M.; Bünermann, O.: Isotope effect suggests site-specific nonadiabaticity on Ge(111)c(2×8). Natural Sciences, e20230019 (2023)
MPG.PuRe
DOI
publisher-version
3.
Journal Article
Floss, P.; Reilly, C. S.; Auerbach, D. J.; Beck, R. D.: Surface-induced vibrational energy redistribution in methane/surface scattering depends on catalytic activity. Frontiers in Chemistry 11, 1238711 (2023)
MPG.PuRe
DOI
publisher-version
4.
Journal Article
Choudhury, A.; Sinha, S.; Harlander, D.; DeVine, J.; Kandratsenka, A.; Saalfrank, P.; Schwarzer, D.; Wodtke, A. M.: Manipulating tunnelling gateways in condensed phase isomerization. Natural Sciences 3 (3), e20230006 (2023)
MPG.PuRe
DOI
publisher-version
5.
Journal Article
Katoch, G.; Prakash, J.; Jasrotia, R.; Verma, A.; Verma, R.; Kumari, S.; Ahmad, T.; Godara, S. K.; Ahmed, J.; Kandwal, A. et al.; Fazil, M.; Maji, P. K.; Kumar, S.; Kumar, G.: Sol-gel auto-combustion developed Nd and Dy co-doped Mg nanoferrites for photocatalytic water treatment, electrocatalytic water splitting and biological applications. Journal of Water Process Engineering 53, 103726 (2023)
MPG.PuRe
DOI
6.
Journal Article
Quan, J.; Yin, R.; Zhao, Z.; Yang, X.; Kandratsenka, A.; Auerbach, D. J.; Wodtke, A. M.; Guo, H.; Park, G. B.: Highly Rotationally Excited N2 Reveals Transition-State Character in the Thermal Decomposition of N2O on Pd(110). Journal of the American Chemical Society 145 (22), pp. 12044 - 12050 (2023)
MPG.PuRe
DOI
publisher-version
7.
Journal Article
Zhao, Z.; Wang, Y.; Yang, X.; Quan, J.; Krüger, B. C.; Stoicescu, P.; Nieman, R.; Auerbach, D. J.; Wodtke, A. M.; Guo, H. et al.; Park, G. B.: Spin-dependent reactivity and spin-flipping dynamics in oxygen atom scattering from graphite. Nature Chemistry 15, pp. 1006 - 1011 (2023)
MPG.PuRe
DOI
publisher-version
8.
Journal Article
Krüger, K.; Wang, Y.; Tödter, S.; Debbeler, F.; Matveenko, A.; Hertl, N.; Zhou, X.; Jiang, B.; Guo, H.; Wodtke, A. M. et al.; Bünermann, O.: Hydrogen atom collisions with a semiconductor efficiently promote electrons to the conduction band. Nature Chemistry 15, pp. 326 - 331 (2023)
MPG.PuRe
DOI
publisher-version
9.
Journal Article
Cobos, C. J.; Tellbach, E.; Sölter, L.; Troe, J.: Influence of Molecular Parameters on Rate Constants of Thermal Dissociation/Recombination Reactions: The Reaction System CF4 ⇄ CF3 + F. The Journal of Physical Chemistry A 127 (7), pp. 1697 - 1701 (2023)
MPG.PuRe
DOI
publisher-version
10.
Journal Article
Lau, J. A.; Verma, V. B.; Schwarzer, D.; Wodtke, A. M.: Superconducting single-photon detectors in the mid-infrared for physical chemistry and spectroscopy. Chemical Society Reviews 52, pp. 921 - 941 (2023)
MPG.PuRe
DOI
publisher-version
11.
Journal Article
Fingerhut, J.; Lecroart, L.; Borodin, D.; Schwarzer, M.; Hoerandl, S.; Kandratsenka, A.; Auerbach, D. J.; Wodtke, A. M.; Kitsopoulos, T. N.: Binding Energy and Diffusion Barrier of Formic Acid on Pd(111). The Journal of Physical Chemistry A 127 (1), pp. 142 - 152 (2023)
MPG.PuRe
DOI
publisher-version
12.
Journal Article
Dorst, A. C.; Dissanayake, R. E. A.; Schauermann, D.; Knies, S.; Wodtke, A. M.; Killelea, D.R.; Schäfer, T.: Hyperthermal velocity distributions of recombinatively-desorbing oxygen from Ag(111). Frontiers in Chemistry 11, 1248456 (2023)
MPG.PuRe
DOI
publisher-version
13.
Journal Article
Reilly, C. S.; Floß, P.; Chen, B.-J.; Auerbach, D. J.; Beck, R. D.: Quantum state-resolved methane scattering from Ni(111) and NiO(111) by bolometer infrared laser tagging: The effect of surface oxidation. The Journal of Chemical Physics 158, 214202 (2023)
MPG.PuRe
DOI
publisher-version
14.
Journal Article
Zhao, K.; Auerbach, D. J.; Campbell, C. T.: Low-Energy Ion Scattering Intensities from Supported Nanoparticles: The Spherical Cap Model. The Journal of Physical Chemistry C 127 (19), pp. 9129 - 9144 (2023)
MPG.PuRe
DOI
15.
Journal Article
Borodin, D.; Galparsoro, O.; Rahinov, I.; Fingerhut, J.; Schwarzer, M.; Horandl, S.; Auerbach, D. J.; Kandratsenka, A.; Schwarzer, D.; Kitsopoulos, T. N. et al.; Wodtke, A. M.: Steric Hindrance of NH3 Diffusion on Pt(111) by Co-Adsorbed O-Atoms. Journal of the American Chemical Society 144 (47), pp. 21791 - 21799 (2022)
MPG.PuRe
DOI
publisher-version
16.
Journal Article
Hertl, N.; Krüger, K.; Bünermann, O.: Electronically Nonadiabatic H Atom Scattering from Low Miller Index Surfaces of Silver. Langmuir 38 (46), pp. 14162 - 14171 (2022)
MPG.PuRe
DOI
17.
Journal Article
Golibrzuch, K.; Walpole, V.; Schönemann, A.-M.; Wodtke, A. M.: Generation of Sub-nanosecond H Atom Pulses for Scattering from Single-Crystal Epitaxial Graphene. The Journal of Physical Chemistry A 126 (43), pp. 8101 - 8110 (2022)
MPG.PuRe
DOI
publisher-version
18.
Journal Article
Choudhury, A.; DeVine, J.; Sinha, S.; Lau, J. A.; Kandratsenka, A.; Schwarzer, D.; Saalfrank, P.; Wodtke, A. M.: Condensed-phase isomerization through tunnelling gateways. Nature 612, pp. 691 - 695 (2022)
MPG.PuRe
DOI
publisher-version
19.
Journal Article
Zhang, Y.; Box, C. L.; Schäfer, T.; Kandratsenka, A.; Wodtke, A. M.; Maurer, R. J.; Jiang, B.: Stereodynamics of adiabatic and non-adiabatic energy transfer in a molecule surface encounter. Physical Chemistry Chemical Physics 24 (33), pp. 19753 - 19760 (2022)
MPG.PuRe
DOI
20.
Journal Article
Schwarzer, M.; Hertl, N.; Nitz, F.; Borodin, D.; Fingerhut, J.; Kitsopoulos, T. N.; Wodtke, A. M.: Adsorption and Absorption Energies of Hydrogen with Palladium. The Journal of Physical Chemistry C 126 (34), pp. 14500 - 14508 (2022)
MPG.PuRe
DOI
publisher-version
21.
Journal Article
Martin-Barrios, R.; Hertl, N.; Galparsoro, O.; Kandratsenka, A.; Wodtke, A. M.; Larregaray, P.: H atom scattering from W(110): A benchmark for molecular dynamics with electronic friction. Physical Chemistry Chemical Physics 24, pp. 20813 - 20819 (2022)
MPG.PuRe
DOI
publisher-version
22.
Journal Article
Ganta, S.; Borter, J.-H.; Drechsler, C.; Holstein, J. J.; Schwarzer, D.; Clever, G. H.: Photoinduced host-to-guest electron transfer in a self-assembled coordination cage. Organic Chemistry Frontiers 9 (20), pp. 5485 - 5493 (2022)
MPG.PuRe
DOI
publisher-version
23.
Journal Article
Oelschlegel, M.; Hua, S.-A.; Schmid, L.; Marquetand, P.; Baeck, A.; Borter, J.-H.; Luecken, J.; Dechert, S.; Wenger, O. S.; Siewert, I. et al.; Schwarzer, D.; Gonzalez, L.; Meyer, F.: Luminescent Iridium Complexes with a Sulfurated Bipyridine Ligand: PCET Thermochemistry of the Disulfide Unit and Photophysical Properties. Inorganic Chemistry 61 (35), pp. 13944 - 13955 (2022)
MPG.PuRe
DOI
24.
Journal Article
Takeyasu, K.; Sawaki, Y.; Imabayashi, T.; Putra, S. E. M.; Halim, H. H.; Quan, J.; Hamamoto, Y.; Hamada, I.; Morikawa, Y.; Kondo, T. et al.; Fujitani, T.; Nakamura, J.: Hydrogenation of Formate Species Using Atomic Hydrogen on a Cu(111) Model Catalyst. Journal of the American Chemical Society 144 (27), pp. 12158 - 12166 (2022)
MPG.PuRe
DOI
25.
Journal Article
Papendorf, K.; Golibrzuch, K.; Zhong, T.; Schwabe, S.; Kitsopoulos, T. N.; Wodtke, A. M.: Velocity‐resolved laser‐induced desorption for kinetics on surface adsorbates. Chemistry–Methods 2 (5), e202200017 (2022)
MPG.PuRe
DOI
publisher-version
26.
Journal Article
DeVine, J.; Choudhury, A.; Lau, J. A.; Schwarzer, D.; Wodtke, A. M.: Spin-Forbidden Carbon–Carbon Bond Formation in Vibrationally Excited α-CO. The Journal of Physical Chemistry A 126 (14), pp. 2270 - 2277 (2022)
MPG.PuRe
DOI
publisher-version
27.
Journal Article
Golibrzuch, K.; Schwabe, S.; Zhong, T.; Papendorf, K.; Wodtke, A. M.: Application of an event-based camera for real-time velocity resolved kinetics. The Journal of Physical Chemistry A 126 (13), pp. 2142 - 2148 (2022)
MPG.PuRe
DOI
publisher-version
28.
Journal Article
Hertl, N.; Kandratsenka, A.; Wodtke, A. M.: Effective medium theory for bcc metals: Electronically non-adiabatic H atom scattering in full dimensions. Physical Chemistry Chemical Physics 24 (15), pp. 8738 - 8748 (2022)
MPG.PuRe
DOI
publisher-version
29.
Journal Article
Ranecky, S. T.; Park, G. B.; Samartzis, P. C.; Giannakidis, I. C.; Schwarzer, D.; Senftleben, A.; Baumert, T.; Schaefer, T.: Detecting chirality in mixtures using nanosecond photoelectron circular dichroism. Physical Chemistry Chemical Physics 24, pp. 2758 - 2761 (2022)
MPG.PuRe
DOI
publisher-version
30.
Journal Article
Bunjes, O.; Paul, L. A.; Dai, X.; Jiang, H.; Claus, T.; Rittmeier, A.; Schwarzer, D.; Ding, F.; Siewert, I.; Wenderoth, M.: Ordering a rhenium catalyst on Ag(001) through molecule-surface step interaction. Communications Chemistry 5, 3 (2022)
MPG.PuRe
DOI
publisher-version
31.
Journal Article
Borodin, D.; Hertl, N.; Park, G. B.; Schwarzer, M.; Fingerhut, J.; Wang, Y.; Zuo, J.; Nitz, F.; Skoulatakis, G.; Kandratsenka, A. et al.; Auerbach, D. J.; Schwarzer, D.; Guo, H.; Kitsopoulos, T. N.; Wodtke, A. M.: Quantum effects in thermal reaction rates at metal surfaces. Science 377, pp. 394 - 398 (2022)
MPG.PuRe
DOI
32.
Journal Article
Dorst, A.C.; Güthoff, F.; Schauermann, D.; Wodtke, A. M.; Killelea, D. R.; Schäfer, T.: Velocity map images of desorbing oxygen from sub-surface states of Rh(111). Physical Chemistry Chemical Physics 24, pp. 26421 - 26427 (2022)
MPG.PuRe
DOI
publisher-version
33.
Journal Article
Borodin, D.; Rahinov, I.; Galparsoro, O.; Fingerhut, J.; Schwarzer, M.; Golibrzuch, K.; Skoulatakis, G.; Auerbach, D. J.; Kandratsenka, A.; Kitsopoulos, T. N. et al.; Wodtke, A. M.: Kinetics of NH3 desorption and diffusion on Pt: Implications for the Ostwald process. Journal of the American Chemical Society 143 (43), pp. 18305 - 18316 (2021)
MPG.PuRe
DOI
34.
Journal Article
Fingerhut, J.; Borodin, D.; Schwarzer, M.; Skoulatakis, G.; Auerbach, D. J.; Wodtke, A. M.; Kitsopoulos, T. N.: The barrier for CO2 functionalization to formate on hydrogenated Pt. Journal of Physical Chemistry A 125 (34), pp. 7396 - 7405 (2021)
MPG.PuRe
DOI
35.
Journal Article
Quan, J.; Chang, Y.; Li, Z.; Zhao, Y.; Luo, Z.; Wu, Y.; Zhang, S.; Chen, Z.; Yang, J.; Yuan, K. et al.; Yang, X.; Krüger, B. C.; Schwarzer, D.; Wodtke, A. M.; Park, G. B.: A free electron laser-based 1+1′ resonance-enhanced multiphoton ionization scheme for rotationally resolved detection of OH radicals with correct relative intensities. Journal of Molecular Spectroscopy 380, 111509 (2021)
MPG.PuRe
DOI
36.
Journal Article
Lecroart, L.; Hertl, N.; Dorenkamp, Y.; Jiang, H.; Kitsopoulos, T. N.; Kandratsenka, A.; Bünermann, O.; Wodtke, A. M.: Adsorbate modification of electronic nonadiabaticity: H atom scattering from p(2 × 2) O on Pt(111). The Journal of Chemical Physics 155 (3), 034702 (2021)
MPG.PuRe
DOI
37.
Journal Article
Hertl, N.; Kandratsenka, A.; Bünermann, O.; Wodtke, A. M.: Multibounce and subsurface scattering of H atoms colliding with a van der Waals solid. The Journal of Physical Chemistry A 125 (26), pp. 5745 - 5762 (2021)
MPG.PuRe
DOI
publisher-version
38.
Journal Article
Hertl, N.; Martin-Barrios, R.; Galparsoro, O.; Larrégaray, P.; Auerbach, D. J.; Schwarzer, D.; Wodtke, A. M.; Kandratsenka, A.: Random force in molecular dynamics with electronic friction. The Journal of Physical Chemistry C 125 (26), pp. 14468 - 14473 (2021)
MPG.PuRe
DOI
publisher-version
39.
Journal Article
Schluschaß, B.; Borter, J.-H.; Rupp, S.; Demeshko, S.; Herwig, C.; Limberg, C.; Maciulis, N. A.; Schneider, J.; Würtele, C.; Krewald, V. et al.; Schwarzer, D.; Schneider, S.: Cyanate formation via photolytic splitting of dinitrogen. JACS Au 1 (6), pp. 879 - 894 (2021)
MPG.PuRe
DOI
publisher-version
40.
Journal Article
Borodin, D.; Rahinov, I.; Fingerhut, J.; Schwarzer, M.; Hörandl, S.; Skoulatakis, G.; Schwarzer, D.; Kitsopoulos, T. N.; Wodtke, A. M.: NO binding energies to and diffusion barrier on Pd obtained with velocity-resolved kinetics. The Journal of Physical Chemistry C 125 (21), pp. 11773 - 11781 (2021)
MPG.PuRe
DOI
publisher-version
41.
Journal Article
Auerbach, D. J.; Tully, J. C.; Wodtke, A. M.: Chemical dynamics from the gas-phase to surfaces. Natural Sciences 1 (1), e10005 (2021)
MPG.PuRe
DOI
publisher-version
42.
Journal Article
Bünermann, O.; Kandratsenka, A.; Wodtke, A. M.: Inelastic scattering of H atoms from surfaces. Journal of Physical Chemistry A 125 (15), pp. 3059 - 3076 (2021)
MPG.PuRe
DOI
publisher-version
43.
Journal Article
Jiang, H.; Tao, X.; Kammler, M.; Ding, F.; Wodtke, A.; Kandratsenka, A.; Miller III, T. F.; Bünermann, O.: Small nuclear quantum effects in scattering of H and D from graphene. Journal of Physical Chemistry Letters 12 (7), pp. 1991 - 1996 (2021)
MPG.PuRe
DOI
44.
Journal Article
Heindl, M.; Jiang, H.; Hua, S.-A.; Oelschlegel, M.; Meyer, F.; Schwarzer, D.; González, L.: Excited-state dynamics of [Ru(S–Sbpy)(bpy)2]2+to form long-lived localized triplet states. Inorganic Chemistry 60 (3), pp. 1672 - 1682 (2021)
MPG.PuRe
DOI
publisher-version
45.
Journal Article
Lau, J. A.; Chen, L.; Choudhury, A.; Schwarzer, D.; Verma, V. B.; Wodtke, A. M.: Transporting and concentrating vibrational energy to promote isomerization. Nature 589 (7842), pp. 391 - 395 (2021)
MPG.PuRe
DOI
46.
Journal Article
Zimara, J.; Stevens, H.; Oswald, R.; Demeshko, S.; Dechert, S.; Mata, R. A.; Meyer, F.; Schwarzer, D.: Time-resolved spectroscopy of photoinduced electron transfer in dinuclear and tetranuclear Fe/Co prussian blue analogues. Inorganic Chemistry 60 (1), pp. 449 - 459 (2021)
MPG.PuRe
DOI
47.
Journal Article
Zimara, J.; Stevens, H.; Oswald, R.; Demeshko, S.; Dechert, S.; Mata, R. A.; Meyer, F.; Schwarzer, D.: Time-resolved spectroscopy of photoinduced electron transfer in dinuclear and tetranuclear Fe/Co Prussian blue analogues. Inorganic Chemistry 60 (1), pp. 449 - 459 (2021)
MPG.PuRe
DOI
48.
Journal Article
Borodin, D.; Schwarzer, M.; Hahn, H. W.; Fingerhut, J.; Wang, Y.; Auerbach, D. J.; Guo, H.; Schroeder, J.; Kitsopoulos, T. N.; Wodtke, A. M.: The puzzle of rapid hydrogen oxidation on Pt(111). Molecular Physics 119 (17-18), e1966533 (2021)
MPG.PuRe
DOI
publisher-version
49.
Journal Article
Wille, S.; Jiang, H.; Bünermann, O.; Wodtke, A. M.; Behler, J.; Kandratsenka, A.: An experimentally validated neural-network potential energy surface for H-atom on free-standing graphene in full dimensionality. Physical Chemistry Chemical Physics 22 (45), pp. 26113 - 26120 (2020)
MPG.PuRe
DOI
publisher-version
supplementary-material
ZIP
50.
Journal Article
Borodin, D.; Golibrzuch, K.; Schwarzer, M.; Fingerhut, J.; Skoulatakis, G.; Schwarzer, D.; Seelemann, T.; Wodtke, A. M.: Measuring transient reaction rates from nonstationary catalysts. ACS Catalysis 10 (23), pp. 14056 - 14066 (2020)
MPG.PuRe
DOI
publisher-version
Web-View
Print Page
Open in new window
Estimated DIN-A4 page-width
Go to Editor View