[57] S. Saha, Y.-T. Chen, S. Ganta, M. Gilles, B. Holzapfel, P. Lill, H. Rehage, C. Gatsogiannis, G. H. Clever, "Coordination cage-based emulsifiers: templated formation of metal oxide microcapsules monitored by in situ LC-TEM", Chem. Eur. J. 2021.
DOI: 10.1002/chem.202103406

[56] M. A. van Spronsen, X. Zhao, M. Jaugstetter, C. Escudero, T. Duchoň, A. Hunt, I. Waluyo, P. Yang, K. Tschulik, M. B. Salmeron, "Interface Sensitivity in Electron/Ion Yield X-ray Absorption Spectroscopy: The TiO2–H2O Interface", J. Phys. Chem. Lett. 2021, 12, 10212-10217.
DOI: 10.1021/acs.jpclett.1c02115

[55] T. Schleif, W. Sander, "Photolysis and thermolysis of (iodomethyl)cyclopropane: Rapid ring opening of cyclopropylcarbinyl via heavy-atom tunneling?" J. Phys. Org. Chem. 2021.
DOI: 10.1002/poc.4295

[54] T. Lohmiller, S. K. Sarkar, J. Tatchen, S. Henkel, T. Schleif, A. Savitsky, E. Sanchez-Garcia, W. Sander, "Sequential Hydrogen Tunneling in o-Tolylmethylene" Chem. Eur. J. 2021, 27.
DOI: 10.1002/chem.202102010

[53] M. Havenith-Newen, E. M. Adams, T. Head-Gordon, H. Hao, M. Rüttermann, I. Leven, H. Wirtz, "Proton Traffic Jam: Effect of Nanoconfinement and Acid Concentration on Proton Hopping Mechanism", Angew. Chem. Int. Ed. 2021, 60, 2 – 11.
DOI: 10.1002/anie.202108766

[52] S. Pullen, G. H. Clever, "Catalysis in Confined Space: Relationship Between Metal–Organic Frameworks and Discrete Coordination Cages" in "Reactivity in Confined Spaces", G. Lloyd (Ed.), R. S. Forgan (Ed.), The Royal Society of Chem­is­try, 2021 (book chapter).
DOI: 10.1039/9781788019705-00247

[51] A. BalaKrishnan, N. Blanc, U. Hagemann, P. Gemagami, K. Wonner, K. Tschulik, T. Li, "Direct Detection of Surface Species Formed on Iridium Electrocatalysts during the Oxygen Evolution Reaction", Angew. Chem. Int. Ed. 2021, 60,2–10.
DOI: 10.1002/anie.202106790

[50] S. Hasegawa, S. L. Meichsner, J. J. Holstein, A. Baksi, M. Kasanmascheff, G. H. Clever, "Long-Lived C60 Radical Anion Stabilized inside an Electron-Deficient Coordination Cage", J. Am. Chem. Soc. 2021, 143, 26, 9718–9723.
DOI: 10.1021/jacs.1c02860

[49] L. Weirich, C. Merten, "Induced VCD and conformational chirality in host-guest complexes of a chiral ammonium salt with crown ethers", Phys. Chem. Chem. Phys. 2021, 23, 18300-18307.
DOI: 10.1039/D1CP01846A

[48] D. Muñoz-Santiburcio, D. Marx, "Confinement-Controlled Aqueous Chemistry within Nanometric Slit Pores", Chem. Rev. 2021, 121, 11, 6293–6320.
DOI: 10.1021/acs.chemrev.0c01292

[47] S. Pullen, J. Tessarolo, G. H. Clever, "Increasing Structural and Functional Complexity in Self-Assembled Coordination Cages", Chem. Sci. 2021, 12, 7269-7293.
DOI: 10.1039/D1SC01226F

[46] S. Kozuch, T. Schleif, A. Karton, "Quantum Mechanical Tunnelling: the Missing Term to Achieve sub-kJ mol-1 Barrier Heights", Phys. Chem. Chem. Phys., 2021, 23, 10888-10898.
DOI: 10.1039/D1CP01275D

[45] S. Pezzotti, A. Serva, F. Sebastiani, F. S. Brigiano, D. R. Galimberti, L. Potier, S. Alfarano, G. Schwaab, M. Havenith, M. Gaigeot, "Molecular Fingerprints of Hydrophobicity at Aqueous Interfaces from Theory and Vibrational Spectroscopies", J. Phys. Chem. Lett. 2021, 12, 3827-3836.
DOI: 10.1021/acs.jpclett.1c00257

[44] D. P. Demarque, M. Kemper, C. Merten, "VCD spectroscopy reveals that a water molecule determines the conformation of azithromycin in solution", Chem. Commun. 2021, 57, 4031-4034.
DOI: 10.1039/D1CC00932J

[43] W. Yu, Y. Wang, P. Gnutt, R. Wanka, L. M. K. Krause, J. A. Finlay, A. S. Clare, A. Rosenhahn,, "Layer-by-Layer Deposited Hybrid Polymer Coatings Based on Polysaccharides and Zwitterionic Silanes with Marine Antifouling Properties", ACS Appl. Bio Mater. 2021, 4, 3, 2385-2397.

[42] S. Juber, S. Wingbermühle, P. Nuernberger, G. H. Clever, L. V. Schäfer, "Thermodynamic Driving Forces of Guest Confinement in a Photoswitchable Cage", Phys. Chem. Chem. Phys. 2021, 23, 7321-7332.

[41] J. Mieres-Perez, K. Lucht, I. Trosien, W. Sander, E. Sanchez-Garcia, K. Morgenstern, "Controlling Reactivity—Real-Space Imaging of a Surface Metal Carbene", J. Am. Chem. Soc. 2021, 143, 12, 4653-4660.

[40] S. Sudan, R. Li, S. M. Jansze, A. Platzek, R. Rudolf, G. H. Clever, F. Fadaei-Tirani, R. Scopelliti, K. Severin, "Identification of a Heteroleptic Pd6L6L′6 Coordination Cage by Screening of a Virtual Combinatorial Library", J. Am. Chem. Soc. 2021, 143, 4, 1773-1778.

[39] A. Balasubramaniam, E. Manderfeld, L. M. K. Krause, R. Wanka, J. Schwarze, C. D. Beyer, A. Rosenhahn, "Visible light-induced controlled surface grafting polymerization of hydroxyethyl methacrylate from isopropylthioxanthone semipinacol-terminated organic monolayers", Polym. Chem. 2021, 12, 618-628.

[38] S. M. Gopal, S. Wingbermühle, J. Schnatwinkel, S. Juber, C. Herrmann, L. V. Schäfer, "Conformational Preferences of an Intrinsically Disordered Protein Domain: A Case Study for Modern Force Fields", J. Phys. Chem. B 2021, 125 (1), 24-35.

[37] K. Lucht, K. Morgenstern, "Polymorphic arrangement of an organic molecule in its hydration environment", J. Chem. Phys. 2021, 154, 014701.

[36] F. Sebastiani, C. Y. Ma, S. Funke, A. Bäumer, D. Decka, C. Hoberg, A. Esser, H. Forbert, G. Schwaab, D. Marx, M. Havenith, "Probing Local Electrostatics of Glycine in Aqueous Solution by THz Spectroscopy", Angew. Chem. Int. Ed. 2021, 60, 3768-3772.
DOI: 10.1002/anie.202014133

[35] K. Wu, B. Zhang, C. Drechsler, J. J. Holstein, G. H. Clever, "Backbone-Bridging Promotes Diversity in Heterloleptic Cages", Angew. Chem. Int. Ed. 2021, 60, 6403-6407.
DOI: 10.1002/anie.202012425


[34] K. Scholten, E. Engelage, C. Merten, "Basis set dependence of S=O stretching frequencies and its consequences for IR and VCD spectra predictions", Phys. Chem. Chem. Phys. 2020, 22, 27979-27986.
DOI: 10.1039/D0CP05420H

[33] J. Koc, L. Schardt, K. Nolte, C. Beyer, T. Eckhard, P. Schwiderowski, J. L. Clarke, J. A. Finlay, A. S. Clare, M. Muhler, A. Laschewsky, A. Rosenhahn, "Effect of Dipole Orientation in Mixed, Charge-Equilibrated Self-assembled Monolayers on Protein Adsorption and Marine Biofouling", ACS Appl. Mater. Interfaces 2020, 12, 45, 50953-50961.
DOI: 10.1021/acsami.0c11580

[32] N. Blanc, C. Rurainsky, K. Tschulik, "Implications of resistance and mass transport limitations on the common Tafel approach at composite catalyst thin-film electrodes", J. Electroanal. Chem. 2020, 872, 114345.
DOI: 10.1016/j.jelechem.2020.114345

[31] T. Schleif, J. Tatchen, J. F. Rowen, F. Beyer, E. Sanchez-Garcia, W. Sander, "Heavy-Atom Tunneling in Semibullvalenes: How Driving Force, Substituents, and Environment Influence the Tunneling Rates", Chem. Eur. J. 2020, 46, 10452-10458.
DOI: 10.1002/chem.202001202

[30] S. Pullen, S. Löffler, A. Platzek, J. J. Holstein, G. H. Clever, "Substrate and Product Binding inside a Stimuli-Responsive Coordination Cage acting as Singlet Oxygen Photosensitizer", Dalton Trans. 2020, 49, 9404-9410.
DOI: 10.1039/D0DT01674H

[29] S. Horiuchi, C. Matsuo, E. Sakuda, Y. Arikawa, G. H. Clever, K. Umakoshi, "Anion-mediated encapsulation-induced emission enhancement of an IrIII complex within a resorcin[4]arene hexameric capsule", Dalton Trans. 2020, 49, 8472-8477.
DOI: 10.1039/d0dt01485k

[28] C. Sprodowski, K. Morgenstern, "Temperature-dependent change of the fractal dimension of Cu dendrites on Cu(111)", New J. Phys. 2020, 22, 063055.
DOI: 10.1088/1367-2630/ab944b

[27] L. Weirich, K. Blanke, C. Merten, "More complex, less complicated? Explicit solvation of hydroxyl groups for the analysis of VCD spectra", Phys. Chem. Chem. Phys 2020, 22, 12515-12523.
DOI: 10.1039/D0CP01656J

[26] S. Ruiz-Barragan, D. Muñoz-Santiburcio, S. Körning, D. Marx, "Quantifying anisotropic dielectric response properties of nanoconfined water within graphene slit pores", Phys. Chem. Chem. Phys. 2020, 22, 10833.
DOI: 10.1039/D0CP00916D

[25] F. Sebastiani, T. A. Bender, S. Pezzotti, W. Li, G. Schwaab, R. G. Bergman, K. N. Raymond, D. Toste, T. Head-Gordon, M. Havenith, "An isolated water droplet in the aqueous solution of a supramolecular tetrahedral cage", PNAS 2020.
DOI: 10.1073/pnas.2012545117

[24] D. Siegmund, N. Blanc, M. Smialkowski, K. Tschulik, U. Apfel, "Metal‐Rich Chalcogenides for Electrocatalytic Hydrogen Evolution – Activity of Electrodes and Bulk Materials", ChemElectroChem 2020, 7, 1-15.
DOI: 10.1002/celc.201902125

[23] C. D. Beyer, M. L. Reback, S. M. Gopal, K. A. Nolte, J. A. Finlay, A. S. Clare, L. V. Schäfer, N. Metzler-Nolte, A. Rosenhahn, "α-Aminoisobutyric Acid Stabilized Peptide SAMs with low Nonspecific Protein Adsorption and Resistance Against Marine Biofouling", ACS Sustainable Chem. Eng. 2020, 8, 7, 2665-2671.
DOI: 10.1021/acssuschemeng.9b05889

[22] K. Wonner, C. Rurainsky, K. Tschulik, "Operando Studies of the Electrochemical Dissolution of Silver Nanoparticles in Nitrate Solutions Observed With Hyperspectral Dark-Field Microscopy", Front. Chem. 2020, 7:912.
DOI: 10.3389/fchem.2019.00912

[21] S. Hasegawa, G. H. Clever, "Metallo-supramolecular Shell Enables Regioselective Multi-functionalization of Fullerenes", Chem 2020, 5-18.
DOI: 10.1016/j.chempr.2019.12.020

[20] M. Müller, J. Henzl, K. Morgenstern, "Confinement of a three-dimensional organic molecule to two dimensions on a surface", Chem. Phys. Lett. 2020, 738, 136906.
DOI: 10.1016/j.cplett.2019.136906

[19] L. Weirich, J. M. de Oliveira, C. Merten, "How many solvent molecules are required to solvate chiral 1,2-diols with hydrogen bonding solvents? A VCD spectroscopic study", Phys. Chem. Chem. Phys. 2020, 22, 1525-1533.
DOI: 10.1039/C9CP06030H

[18] M. Vyshnepolsky, K. Morgenstern, "Common structures of CO2 on structurally different coin metal surfaces", Phys. Chem. Chem. Phys. 2020, 22, 497-506.
DOI: 10.1039/C9CP05813C


[17] B. Chen, S. Horiuchi, J. J. Holstein, J. Tessarolo, G. H. Clever, "Tunable Fullerene Affinity of Cages, Bowls and Rings Assembled by PdII Coordination Sphere Engineering", Chem. Eur. J. 2019, 25, 14921-14927.
DOI: 10.1002/chem.201903317

[16] C. Sprodowski, K. Morgenstern, "Influence of misfit dislocations on nanoisland decay", Phys. Rev. B 2019, 100, 045402.
DOI: 10.1103/PhysRevB.100.045402

[15] S. Funke, F. Sebastiani, G. Schwaab, M. Havenith, "Spectroscopic fingerprints in the low frequency spectrum of ice (Ih), clathrate hydrates, supercooled water, and hydrophobic hydration reveal similarities in the hydrogen bond network motifs", J. Chem. Phys. 2019, 150, 224505.
DOI: 10.1063/1.5097218

[14] L. Weirich, C. Merten, "Solvation and self-aggregation of chiral alcohols: how hydrogen bonding affects their VCD spectral signatures", Phys. Chem. Chem. Phys. 2019, 21, 13494.
DOI: 10.1039/C9CP01407A

[13] K. E. Ebbert, L. Schneider, A. Platzek, C. Drechsler, B. Chen, R. Rudolf, G. H. Clever, "Resolution of minor size differences in a family of heteroleptic coordination cages by trapped ion mobility ESI-MS", Dalton Trans. 2019, 48, 11070-11075.
DOI: 10.1039/C9DT01814J

[12] C. Sprodowski, K. Morgenstern, "Altering the stability of nanoislands through core-shell supports", Nanoscale 2019, 11, 10314-10319.
DOI: 10.1039/C9NR00529C

[11] B. Chen, J. J. Holstein, S. Horiuchi, W. G. Hiller, G. H. Clever, "Pd(II) Coordination Sphere Engineering: Pyridine Cages, Quinoline Bowls and Heteroleptic Pills Binding One or Two Fullerenes", J. Am. Chem. Soc. 2019, 141, 22, 8907-8913.
DOI: 10.1021/jacs.9b02207

[10] C. Sprodowski, K. Morgenstern, "Temperature-Dependent Accommodation of Two Lattices of Largely Different Size during Growth", Nanomaterials 2019, 9(5), 710.
DOI: 10.3390/nano9050710

[9] R. Li, M. Han, J. Tessarolo, J. J. Holstein, J. Lübben, B. Dittrich, C. Volkmann, M. Finze, C. Jenne, G. H. Clever, "Successive Photoswitching and Derivatization Effects in Photochromic Dithienylethene‐Based Coordination Cages", ChemPhotoChem 2019, 3, 378-383.
DOI: 10.1002/cptc.201900038

[8] M. V. Evers, M. Bernal, B. R. Cuenya, K. Tschulik, "Piece by Piece—Electrochemical Synthesis of Individual Nanoparticles and their Performance in ORR Electrocatalysis", Angew. Chem. Int. Ed. 2019, 58, 8221-8225.
DOI: 10.1002/anie.201813993

[7] C. Sprodowski, K. Morgenstern, "Induced Growth from a Ag Gas on Cu(111)", J. Phys. Chem. C 2019, 123, 15, 9846-9851.
DOI: 10.1021/acs.jpcc.9b00478

[6] K. Wonner, M. V. Evers, K. Tschulik, "The electrochemical dissolution of single silver nanoparticles enlightened by hyperspectral dark-field microscopy", Electrochimica Acta 2019, 301, 458-464.
DOI: 10.1016/j.electacta.2019.01.129

[5] R. Li, J. J. Holstein, W. G. Hiller, J. Andréasson, G. H. Clever, "Mechanistic Interplay between Light Switching and Guest Binding in Photochromic [Pd2Dithienylethene4] Coordination Cages", J. Am. Chem. Soc. 2019, 141, 5, 2097-2103.
DOI: 10.1021/jacs.8b11872


[4] S. Ruiz-Barragan, D. Muñoz-Santiburcio, D. Marx, "Nanoconfined Water within Graphene Slit Pores Adopts Distinct Confinement-Dependent Regimes", J. Phys. Chem. Lett. 2019, 10, 3, 329-334.
DOI: 10.1021/acs.jpclett.8b03530

[3] F. Octa-Smolin, M. Thiele, R. Yadav, A. Platzek, G. H. Clever, J. Niemeyer, "Chiral Receptors for Lysine Based on Covalently Linked Bis- and Tris-binaphthylphosphoric Acids", Org. Lett. 2018, 20, 19, 6153-6156.
DOI: 10.1021/acs.orglett.8b02619

[2] S. Pullen, G. H. Clever, "Mixed-Ligand Metal–Organic Frameworks and Heteroleptic Coordination Cages as Multifunctional Scaffolds - A Comparison", Acc. Chem. Res. 2018, 51, 12, 3052-3064.
DOI: 10.1021/acs.accounts.8b00415

[1] R. Zhu, W. M. Bloch, J. J. Holstein, S. Mandal, L. V. Schäfer, G. H. Clever, "Donor‐Site‐Directed Rational Assembly of Heteroleptic cis‐[Pd2L2L′2] Coordination Cages from Picolyl Ligands", Chem. Eur. J. 2018, 24, 12976-12982.
DOI: 10.1002/chem.201802188