Publications of the department of molecular physics

Pappas, C. G.; Mandal, P. K.; Liu, B.; Kauffmann, B.; Miao, X.; Komáromy, D.; Hoffmann, W.; Manz, C.; Chang, R.; Liu, K. et al.; Pagel, K.; Huc, I.; Otto, S.: Emergence of low-symmetry foldamers from single monomers. Nature Chemistry 12, pp. 1180 - 1186 (2020)

Kale, S. K.; Ding, Y.; Chen, Y. P.; Friedrich, B.; Kais, S.: Spin-momentum entanglement in a Bose–Einstein condensate. Physical Chemistry Chemical Physics 22 (44), pp. 25669 - 25674 (2020)

Greis, K.; Kirschbaum, C.; Leichnitz, S.; Gewinner, S.; Schöllkopf, W.; Helden, G. v.; Meijer, G.; Seeberger, P. H.; Pagel, K.: Direct Experimental Characterization of the Ferrier Glycosyl Cation in the Gas Phase. Organic Letters 22 (22), pp. 8916 - 8919 (2020)

Liu, X.; Meijer, G.; Pérez-Ríos, J.: A data-driven approach to determine dipole moments of diatomic molecules. Physical Chemistry Chemical Physics 22 (42), pp. 24191 - 24200 (2020)

Jahnke, T.; Hergenhahn, U.; Winter, B.; Dörner, R.; Frühling, U.; Demekhin, P. V.; Gokhberg, K.; Cederbaum, L. S.; Ehresmann, A.; Knie, A. et al.; Dreuw, A.: Interatomic and Intermolecular Coulombic Decay. Chemical Reviews 120 (20), pp. 11295 - 11369 (2020)

Müller, F.; Stückrath, J. B.; Bischoff, F. A.; Gagliardi, L.; Sauer, J.; Debnath, S.; Jorewitz, M.; Asmis, K. R.: Valence and Structure Isomerism of Al₂FeO₄⁺: Synergy of Spectroscopy and Quantum Chemistry. Journal of the American Chemical Society 142 (42), pp. 18050 - 18059 (2020)

Grundmann, S.; Trabert, D.; Fehre, K.; Stenger, N.; Pier, A.; Kaiser, L.; Kircher, M.; Weller, M.; Eckart, S.; Schmidt, L. P. H. et al.; Trinter, F.; Jahnke, T.; Schöffler, M. S.; Dörner, R.: Zeptosecond birth time delay in molecular photoionization. Science 370 (6514), pp. 339 - 341 (2020)

Kastirke, G.; Schöffler, M. S.; Weller, M.; Rist, J.; Boll, R.; Anders, N.; Baumann, T. M.; Eckart, S.; Erk, B.; De Fanis, A. et al.; Fehre, K.; Gatton, A.; Grundmann, S.; Grychtol, P.; Hartung, A.; Hofmann, M.; Ilchen, M.; Janke, C.; Kircher, M.; Kunitski, M.; Li, X.; Mazza, T.; Melzer, N.; Montano, J.; Music, V.; Nalin, G.; Ovcharenko, Y.; Pier, A.; Rennhack, N.; Rivas, D. E.; Dörner, R.; Rolles, D.; Rudenko, A.; Schmidt, P.; Siebert, J.; Stenger, N.; Trabert, D.; Vela-Perez, I.; Wagner, R.; Weber, T.; Williams, J. B.; Ziolkowski, P.; Schmidt, L. P. H.; Czasch, A.; Ueda, K.; Trinter, F.; Meyer, M.; Demekhin, P. V.; Jahnke, T.: Double Core-Hole Generation in O₂ Molecules Using an X-Ray Free-Electron Laser: Molecular-Frame Photoelectron Angular Distributions. Physical Review Letters 125 (16), 163201 (2020)

Amin, K. S.; Hu, X.; Salahub, D. R.; Baldauf, C.; Lim, C.; Noskov, S.: Benchmarking polarizable and non-polarizable force fields for Ca²⁺-peptides against a comprehensive QM dataset. The Journal of Chemical Physics 153 (14), 144102 (2020)

Kaiser, L.; Fehre, K.; Novikoskiy, N. M.; Stindl, J.; Tsitsonis, D.; Gopakumar, G.; Unger , I.; Söderström, J.; Björneholm, O.; Schöffler, M. et al.; Jahnke, T.; Dörner, R.; Trinter, F.; Demekhin, P. V.: Angular emission distribution of O 1s photoelectrons of uniaxially oriented methanol. Journal of Physics B 53 (19), 194002 (2020)

Grabarics, M.; Lettow, M.; Kirk, A. T.; Helden, G. v.; Causon, T. J.; Pagel, K.: Plate-height model of ion mobility-mass spectrometry. Analyst 145 (19), pp. 6313 - 6333 (2020)

Bagschik, K.; Schneider, M.; Wagner, J.; Buss, R.; Riepp, M.; Philippi-Kobs, A.; Müller, L.; Rosecker, W.; Trinter, F.; Hoesch, M. et al.; Viefhaus, J.; Eisebitt, S.; Grübel, G.; Oepen, H. P.; Frömter, R.: Enabling time-resolved 2D spatial-coherence measurements using the Fourier-analysis method with an integrated curved-grating beam monitor. Optics Letters 45 (19), pp. 5591 - 5594 (2020)

Bielik, T.; Friedrich, B.: Far Apart and Close Together: Fritz Haber and Chaim Weizmann. Israel Journal of Chemistry 60 (10-11), pp. 1061 - 1076 (2020)

Eckart, S.; Fehre, K.; Geyer, A.; Rist, J.; Lin, K.; Trinter, F.; Schmidt, L. P. H.; Schöffler, M. S.; Jahnke, T.; Kunitski, M. et al.; Dörner, R.: Sideband modulation by subcycle interference. Physical Review A 102 (4), 043115 (2020)

Mudryk, K. D.; Siedel, R.; Winter, B.; Wilkinson, I.: The electronic structure of the aqueous permanganate ion: aqueous-phase energetics and molecular bonding studied using liquid jet photoelectron spectroscopy. Physical Chemistry Chemical Physics 22 (36), pp. 20311 - 20330 (2020)

Meizyte, G.; Green, A. E.; Gentleman, A. S.; Schaller, S.; Schöllkopf, W.; Fielicke, A.; Mackenzie, S. R.: Free electron laser infrared action spectroscopy of nitrous oxide binding to platinum clusters, Pt_n(N₂O)_m⁺. Physical Chemistry Chemical Physics 22 (33), pp. 18606 - 18613 (2020)

Thomas, D.; Chang, R.; Mucha, E.; Lettow, M.; Greis, K.; Gewinner, S.; Schöllkopf, W.; Meijer, G.; Helden, G. v.: Probing the conformational landscape and thermochemistry of DNA dinucleotide anions via helium nanodroplet infrared action spectroscopy. Physical Chemistry Chemical Physics 22 (33), pp. 18400 - 18413 (2020)

Greis, K.; Mucha, E.; Lettow, M.; Thomas, D.; Kirschbaum, C.; Moon, S.; Pardo-Vargas, A.; Helden, G. v.; Meijer, G.; Gilmore, K. et al.; Seeberger, P. H.; Pagel, K.: The Impact of Leaving Group Anomericity on the Structure of Glycosyl Cations of Protected Galactosides. ChemPhysChem 21 (17), pp. 1905 - 1907 (2020)

Warnecke, J.; Mayer, M.; Rohdenburg, M.; Ma, X.; Liu, J. K. Y.; Grellmann, M.; Debnath, S.; Azov, V. A.; Apra, E.; Young, R. P. et al.; Jenne, C.; Johnson, G. E.; Kenttämaa, H. I.; Asmis, K. R.; Laskin, J.: Direct functionalization of C-H bonds by electrophilic anions. Proceedings of the National Academy of Sciences of the United States of America 117 (38), pp. 23374 - 23379 (2020)

Lettow, M.; Grabarics, M.; Greis, K.; Mucha, E.; Thomas, D.; Chopra, P.; Boons, G.-J.; Karlsson, R.; Turnbull, J. E.; Meijer, G. et al.; Miller, R. L.; Helden, G. v.; Pagel, K.: Cryogenic Infrared Spectroscopy Reveals Structural Modularity in the Vibrational Fingerprints of Heparan Sulfate Diastereomers. Analytical Chemistry 92 (15), pp. 10228 - 10232 (2020)