All Publications
210 publications found:
Polymer-templated films of ordered mesoporous carbon: preparation, characterization and applications
- Review - M. Huber, P. Sonnenberg and S. Naumann Polym. Chem., 2025, Advance Article.
Upconversion Nanoparticle-Covalent Organic Framework Core–shell Particles as Therapeutic Microrobots Trackable With Optoacoustic Imaging
D. W. Kim, P. Wrede, A. Rodríguez-Camargo, Y. Chen, N. O. Dogan, Ch. Glück, B. V. Lotsch, D. Razansky and M. Sitti Adv. Mater. 2025, 2418425.
Computational Approach for Determining Molecular Diameters and Access to Pores
K. Gugeler, J. Kästner and M. Dyballa ACS Catal. 2025, 15, XXX, 4798–4816.
Ring-Expansion Metathesis Polymerization Under Confinement
P. Probst, M. Lindemann, J. R. Bruckner, B. Atwi, D. Wang, F. R. Fischer, M. Högler, M. Bauer, N. Hansen, M. Dyballa and M. R. Buchmeiser J. Am. Chem. Soc. 2025, 147, 8741–8750.
Synthesis of micrometre-thick oriented 2D covalent organic framework films by a kinetic polymerization pathway
L. Cusin, P. Cieciórski, S. Van Gele, F. Heck, S. Krause, P. W. Majewski, B. V. Lotsch, W. Danowski and P. Samorì Nat. Synth 2025.
Digitalization of biocatalysis: Best practices to research data management
- PERSPECTIVE - T. Giess, J.Pleiss Methods Enzymol, 2025, in press.
Cyclopalladation of a covalent organic framework for near-infrared-light-driven photocatalytic hydrogen peroxide production
A. Rodríguez-Camargo, M. W. Terban, M. Paetsch, E. A. Rico, D. Graf, R. Hirpara, V. Duppel, I. Moudrakovski, M. Etter, N. Guijarro, Ch. Ochsenfeld, R. E. Dinnebier, L. Yao and B. V. Lotsch Nat. Synth 2025.
Molecular determinants of solvent nanoseparation by nanoporous carbon materials
S. Kolin, M. Marquardt, G. Fläschner, S. Naumann, K. Pluhackova ChemRxiv. 2025, preprint.
Room Temperature Ethene to Propene (ETP) Tandem Catalysis using Single Crystalline Solid-State Molecular Pre-Catalysts
K. M. Altus, Y. Shi, P. Probst, J. H. Heaton, M. R. Gyton, L. Lari, M. R. Buchmeiser, P. W. Dyer and A. S. Weller Angew. Chem. Int. Ed. 2025, 64, e202419923.
Diethylaluminium Chloride-Mediated Cycloaddition/Conjugate Reduction Sequence towards Imido-Substituted Norbornenes
M. Kirchhof, D. Batman, E. Nicholas, W. Frey, V. Derdau, A. Zens and S. Laschat Eur. J. Org. Chem. 2025, e202401270.
Solvothermal Template-Induced Hierarchical Porosity in Covalent Organic Frameworks: A Pathway to Enhanced Diffusivity
F. Heck, L. Grunenberg, N. Schnabel, A. Heilmaier, T. Sottmann, L. Yao and B. V. Lotsch Adv. Mater. 2025, 2415882.
Shedding Light on the Active Species in a Cobalt-Based Covalent Organic Framework for the Electrochemical Oxygen Evolution Reaction
P. Hosseini, A. Rodríguez-Camargo, Y. Jiang, S. Zhang, Ch. Scheu, L. Yao, B. V. Lotsch and K. Tschulik Adv. Sci. 2025, 12, 2413555.
Crystalline porous frameworks based on double extension of metal-organic and covalent organic linkages
K. Endo, S. Canossa, F. Heck, D. M. Proserpio, M. S. Istek, F. Stemmler, J. van Slageren, S. Hartmann, A. Hartschuh and B. V. Lotsch Nat. Synth 2025.
Chromium(II)/(III) Complexes Bearing Phosphino-N-Heterocyclic Carbene and N-Chelating N-Heterocyclic Carbene Ligands and Their Use in Ethylene Oligomerization
S. Bhattacharya, B. Atwi, K. Kundu, W. Frey and M. R. Buchmeiser Organometallics 2025, 44, 315−324.
Influence of Ionic Liquid Film Thickness and Flow Rate on Macrocyclization Efficiency and Selectivity in Supported Ionic Liquid-Liquid Phase Catalysis
M. Högler, T. Kobayashi, H. Kraus, B. Atwi, M. R. Buchmeiser, M. Fyta and N. Hansen Chem. Eur. J. 2025, 31, e202403237.
Influence of water content on thermophysical properties of aqueous glyceline solutions predicted by molecular dynamics simulations
M. B.M. Spera, S. Darouich, J. Pleiss and N. Hansen Fluid Ph Equilib 2025, 592, 114324.
Origin of Stereoselectivity in Ring Opening Metathesis Polymerization with Cationic Molybdenum Imido Alkylidene CAAC Complexes
K. Kundu, S. Haid, M. R. Schäfer, W. Frey, J. Kästner and M. R. Buchmeiser ACS Catal. 2025, 15, 738−747.
The Devil Is in the Details: Pitfalls and Ambiguities in the Analysis of X-ray Powder Diffraction Data of 2D Covalent Organic Frameworks
S. Van Gele, S. Bette and B. V. Lotsch JACS Au 2025, 5, 1, 388–398.
Strategies to achieve reproducible synthesis of phase-pure Zr-porphyrin metal-organic frameworks
- PERSPECTIVE - K. Hemmer, H. L. B. Boström, S. Krause, B. V. Lotsch and R. A. Fischer Commun Mater 2024, 5, 264.
Using Support Effects to Increase the Productivity of Immobilized Ruthenium Hydride Catalysts for the Hydrogenation of CO2
H.-H. Nguyen, M. Dyballa and D. P. Estes Inorg. Chem. 2024, 63, 23479−23486.
Structural Characterization of Surface Immobilized Platinum Hydrides by Sensitivity-Enhanced 195Pt Solid State NMR Spectroscopy and DFT Calculations
B. A. Atterberry, E. Wimmer, S. Klostermann, W. Frey, J. Kästner, D. Estes and A. J Rossini Chem. Sci., 2024, Accepted Manuscript.
CO2-induced drastic decharging of dielectricsurfaces in aqueous suspensions
P. Vogel, D. Beyer, Ch. Holm and T. Palberg Soft Matter 2024, Advance Article
Linker-Cluster Cooperativity in Confinement of Proline-Functionalized Zr-Based Metal-Organic Frameworks and its Effect on the Organocatalytic Aldol Reaction
Z. Dilruba, A. Dadgar Yeganeh, S. Kolin, S. Noor, H. Shatla, C. Wieland ,B.-H. Yu ,K. Gugeler , A. Zens, J. Kästner, D. Estes, K. Pluhackova ,S. Krause and S. Laschat ChemRxiv. 2024, preprint.
The Role of Spacer Length in Macrocyclization Reactions Under Confinement
M. Nandeshwar, K. Weisser, F. Ziegler, W. Frey and M. R. Buchmeiser ChemCatChem 2024, 17, e202401561.
Modeling Enzyme Kinetics: Current Challenges and Future Perspectives for
- PERSPECTIVE - J. Pleiss Biochemistry 2024, 63, 20, 2533–2541.
Celebrating Ten Years of Covalent Organic Frameworks for Solar Energy Conversion: Past, Present and Future
- MINIREVIEW - A. Rodríguez-Camargo, K. Endo and B. V. Lotsch Angew. Chem. Int. Ed. 2024, e202413096.
Hydrogen spillover through hydride transfer: the reaction of ZnO and ZrO2 with strong hydride donors
M. Benz, O. Bunjaku, M. Nowakowski, A. Allgaier, I. Biswas, J. van Slageren, M. Bauer and D. P. Estes Catal. Sci. Technol., 2024, 14, 5854-5863.
Feed injection in liquid chromatography: Reducing the effect of large-volume injections from purely organic diluents in reversed-phase liquid chromatography
A. Böth, D. Foshag, Ch.Schulz, B. Atwi, S. E. Maier, D. P.Estes, M. R. Buchmeiser, T. van de Goor and U. Tallarek J. Chromatogr. A 2024, 1730, 465165.
Effects of Surfaces and Confinement on Formic Acid Dehydrogenation Catalyzed by an Immobilized Ru–H Complex: Insights from Molecular Simulation and Neutron Scattering
H.-H. Nguyen, M. Högler, N. Schnabel, N. Hansen, T. Sottmann and D. P. Estes ACS Catal. 2024, 14, 11252–11261.
Probing Self-Diffusion of Guest Molecules in a Covalent Organic Framework: Simulation and Experiment
L. Grunenberg, Ch. Keßler, T. Wei Teh, R. Schuldt, F. Heck, J. Kästner, J. Groß, N. Hansen and B. V. Lotsch ACS Nano 2024, 18, 25, 16091–16100.
Asymmetric Rh Diene Catalysis under Confinement: Isoxazole Ring-Contraction in Mesoporous Solids
M. Marshall, Z. Dilruba, A.-K. Beurer, K. Bieck, S. Emmerling, F. Markus, Ch. Vogler, F. Ziegler, M. Fuhrer, S. S. Y. Liu, S. R.Kousik, W. Frey, Y. Traa, J. R. Bruckner, B. Plietker, M. R. Buchmeiser, S. Ludwigs, S. Naumann, P. Atanasova, B. V. Lotsch, A. Zens and S. Laschat Eur. J. Org. Chem. 2024, 27, e202400283.
Reversible Oxidative Additions of Weak Acids to Pd(0) Complexes: Effects on Pd–H-Catalyzed Enyne Cycloisomerization
E. J. Wimmer and D. P. Estes Organometallics 2024, 43, 9, 1068–1075.
Detection and Characterization of Hydride Ligands in Copper Complexes by Hard X-ray Spectroscopy
L.Fritsch, P. Rehsies, W. Barakat, D. P. Estes and M. Bauer Chem. Eur. J.2024, e202400357.
Synthetic and Structural Peculiarities of Neutral and Cationic Molybdenum Imido and Tungsten Oxo Alkylidene Complexes Bearing Weakly Coordinating N-Heterocyclic Carbenes
M.R. Buchmeiser, D. Wang, R. Schowner, L. Stöhr, F. Ziegler, S. Sen and W. Frey Eur. J. Inorg. Chem. 2024, 27, e202400082.
Understanding the Reducibility of CeO2 Surfaces by Proton–Electron Transfer from CpCr(CO)3H
O. Bunjaku, J. Florenski, J. Wischnat, E. Klemm, O. V. Safonova, J. van Slageren, and D. P. Estes Inorg. Chem. 2024, 63, 16, 7512–7519.
Machine learning-assisted measurement of lithium transport using operando optical microscopy
N. Kerner, Y. Joshi, M. Mead, S. Eich, R. Talei and G. Schmitz Acta Materialia 2024, 270, 119867.
Covalent Organic Frameworks as Single-Site Photocatalysts for Solar-to-Fuel Conversion
- PERSPECTIVE - L. Yao, A. M. Pütz, H. Vignolo-González and B. V. Lotsch J. Am. Chem. Soc. 2024, 146, 14, 9479–9492.
Mesoionic N-Heterocyclic Olefins as Initiators for the Lewis Pair Polymerization of Epoxides
I. Haug, J. Reitz, C. Ziane, M. R. Buchmeiser, M. M. Hansmann and S. Naumann Macromol. Rapid Commun. 2024, 2300716.
Fluent Integration of Laboratory Data into Biocatalytic Process Simulation Using EnzymeML, DWSIM, and Ontologies
A. S. Behr, J. Surkamp, E. Abbaspour, M. Häußler, S. Lütz, J. Pleiss, N. Kockmann and K. Rosenthal Processes 2024, 12, 597.
Stereoselective Ring Expansion Metathesis Polymerization with Cationic Molybdenum Alkylidyne N-Heterocyclic Carbene Complexes
P. Probst, J. Groos, D. Wang, A. Beck, K. Gugeler, J. Kästner, W. Frey and M. R. Buchmeiser J. Am. Chem. Soc. 2024, 146, 12, 8435–8446.
Olefin Metathesis and Stereoselective Ring-Opening Metathesis Polymerization with Neutral and Cationic Molybdenum(VI) Imido and Tungsten(VI) Oxo Alkylidene Complexes Containing N‑Chelating N‑Heterocyclic Carbenes
S. Bhattacharya, F. Ziegler, D. Wang, W. Frey and M. R. Buchmeiser Organometallics 2024, 43, 6, 677−688.
Extracting free energies from local composition fluctuations in solids: A frequency distribution analysis of simulated atom probe data obtained by TAPSim
J. Zheng, M. Poul, G. Schmitz and S. M. Eich Acta Materialia 2024, 269, 119807.
Modulation of peripheral functional groups for the enhancement of electrochemical HER activity in bimetallic Ni-containing triply-fused porphyrins
A. S. Hazari ,S. Chandra ,P. Becker ,H. Liu ,E. Klemm ,J. Kästner and B. Sarkar ChemRxiv. 2024, Working Paper.
FAIR Data and Software: Improving Efficiency and Quality of Biocatalytic Science
- PERSPECTIVE - Jürgen Pleiss ACS Catal. 2024, 14, 4, 2709–2718.
Comparison of the Catalytic Activity of Surface-Immobilized Copper Complexes with Phosphonate Anchoring Groups for Atom Transfer Radical Cyclizations and Additions
S. E. Maier, T. Nagel, M. Turan, E. Kaya, W. Frey, M. Dyballa and D. P. Estes Organometallics 2024, 43, 3, 233–241.
Downsizing Porphyrin Covalent Organic Framework Particles Using Protected Precursors for Electrocatalytic CO2 Reduction
K. Endo, A. Raza, L. Yao, S. Van Gele, A. Rodríguez-Camargo, H. A. Vignolo-González, L. Grunenberg, and B. V. Lotsch Adv. Mater.2024, 2313197.
Chirality Transfer of Stereogenic Boron Centers Enabled by a SN2-Type Mechanism
Y. Stöckl, K. Gugeler, C. M. Holzwarth, W. Frey, S. Wegner, B. Claasen, A. Zens, D. Gudat, Ch. P. Sindlinger, J. Kästner and S. Laschat Organometallics 2024, 43, 3, 330–340.
Isolation, Characterization and Reactivity of Key Intermediates Relevant to Reductive (Electro)catalysis with Cp*Rh Complexes Containing Pyridyl-MIC (MIC=Mesoionic Carbene) Ligands
T. Bens, R. R. M. Walter, J. Beerhues, C. Lücke, J. Gabler and B. Sarkar Chem. Eur. J. 2024, 30, e202302354.
Disentanglement of Surface and Confinement Effects for Diene Metathesis in Mesoporous Confinement
I. Tischler, A. Schlaich and Ch. Holm ACS Omega2024, 9, 1, 598–606.
Active Site Engineering in Reticular Covalent Organic Frameworks for Photocatalytic CO2 Reduction
- REVIEW - B.B. Rath, S. Krause and B. V. Lotsch Adv. Funct. Mater.2023, 2309060.
Accessibility of Reactants and Neighborhood of Mo Species during Methane Aromatization Uncovered by Operando NAP-XPS and MAS NMR
S. Peters, C. Rieg, S. Bartling, M. Parlinska-Wojtan, M. Dyballa, S. Wohlrab and A. M. Abdel-Mageed ACS Catal. 2023, 13, 19, 13056–13070.
Manipulate – techniques to manipulate the surroundings of a synthetic catalyst to control activity and selectivity: general discussion
- GENERAL DISCUSSION - T. Beweries, M. R. Buchmeiser, N. R. Champness, M. Costas, A. Duhme-Klair, J. Echeverría, O. Eisenstein, C. T. J. Ferguson, J. C. Goodall, R. Gramage-Doria, M. Gyton, R. Ham, S. Herres-Pawlis, Ch. L. Johnson, P. Kennepohl, B. Lewandowski, P. R. Linnebank, S. A. Macgregor, K. T. Mahmudov, E. Meeus, M. Navarro, P. Ntola, T. N. Parac-Vogt, R. N. Perutz, A. Poater, D. C. Powers, S. Pullen, P. R. Raithby, Joost N. H. Reek, T. R. Ward, A. S. Weller and H. Wennemers
Faraday Discuss., 2023, 244, 96-118.
Make – underpinning concepts of the synthesis of systems where non-covalent interactions are important: general discussion
- GENERAL DISCUSSION - T. Beweries, M. R. Buchmeiser, F. E. Bugden, N. R. Champness, B. Chanbasha, M. Costas, J. Echeverria, O. Eisenstein, C. Ferguson, J. C. Goodall, R. Gramage-Doria, M. Greenhalgh, M. Gyton, R. Ham, P. Kennepohl, B. Lewandowski, W.-Ch. Liu, S. A. Macgregor, K. T. Mahmudov, E. Meeus, J. Morris, P. Ntola, T. N. Parac-Vogt, R. N. Perutz, A. Poater, D. Powers, P. R. Raithby, J. N. H. Reek, I. Riddell, T. R. Ward, A. S. Weller and H. Wennemers
Faraday Discuss., 2023, 244, 434-454.
Solvent Effects on Structure and Screening in Confined Electrolytes
J. Yang, S. Kondrat, Ch. Lian, H. Liu, A. Schlaich and Ch. Holm Phys. Rev. Lett. 2023, 131, 118201.
Macrocyclization of Dienes Under Confinement With Cationic Tungsten Imido/Oxo Alkylidene N-Heterocyclic Carbene Complexes
F. Ziegler, J. R. Bruckner, M. Nowakowski, M. Bauer, P. Probst, B. Atwi, M. R. Buchmeiser ChemCatChem, 2023,15 (21), e202300871.
A screening of results on the decay length in concentrated electrolytes
H. Jäger, A. Schlaich, J. Yang, Ch. Lian, S. Kondrat and Ch. Holm Faraday Discuss., 2023, 246, 520-539.
Acceleration of indirect detection 195Pt solid-state NMR experiments bysideband selective excitation or alternative indirect sampling schemes
B. A. Atterberry, E. Wimmer, D. P. Estes and A. J. Rossini J. Magn. Reson. 2023, 352, 107457.
In Situ Ultra-Small- and Small-Angle X-ray Scattering Study of ZnO Nanoparticle Formation and Growth through Chemical Bath Deposition in the Presence of Polyvinylpyrrolidone
K. Abitaev, P. Atanasova, J. Bill, N. Preisig, I. Kuzmenko, J. Ilavsky, Y. Liu and T. Sottmann Nanomaterials 2023, 13 (15), 2180.
Performance of two complementary machine-learned potentials in modelling chemically complex systems
K. Gubaev, V. Zaverkin, P. Srinivasan, A. I. Duff, J. Kästner and B. Grabowski npj Comput Mater 2023, 9, 129.
A Complementary Experimental and Theoretical Approach for Probing the Surface Functionalization of ZnO with Molecular Catalyst Linkers
S. R. Kousik, H. Solodenko, A. YazdanYar, M. Kirchhof, P. Schützendübe, G. Richter, S. Laschat, M. Fyta, G. Schmitz, J. Bill and P. Atanasova Adv. Mater. Interfaces 2023, 2300399.
Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models
H. Kraus, M. Högler and N. Hansen J. Phys. Chem. C 2023, 127, 29, 14374–14388.
Perspective: Functional dynamics in framework materials
- PERSPECTIVE - S. Krause and J. V. Milić Commun. Chem. 2023, 6, 151.
Entropic barrier of water permeation through single-file channels
J. Wachlmayr, G. Fläschner, K. Pluhackova, W. Sandtner, Ch. Siligan and A. Horner Commun. Chem. 2023, 6, 135.
Neutral and Cationic Molybdenum Imido Alkylidene Cyclic Alkyl Amino Carbene (CAAC) Complexes for Olefin Metathesis
K. Kundu, J. V. Musso, M. J. Benedikter, W. Frey, K. Gugeler, J. Kästner and M. R. Buchmeiser Chem. Eur. J. 2023, 29, e202301818.
Cooperative Lewis Acid–1,2,3-Triazolium–Aryloxide Catalysis: Pyrazolone Addition to Nitroolefins as Entry to Diaminoamides
D. M. Wanner, P. M. Becker, S. Suhr, N. Wannenmacher, S. Ziegler, J. Herrmann, F. Willig, J. Gabler, K. Jangid, J. Schmid, A. C. Hans, W. Frey, B. Sarkar, J. Kästner and R. Peters Angew. Chem. Int. Ed. 2023, 62, e202307317.
Surface immobilized Cu-1,10-phenanthroline complexes with α-aminophosphonate groups in the 5-position as heterogenous catalysts for efficient atom-transfer radical cyclizations
S. E. Maier, O. Bunjaku, E. Kaya, M. Dyballa, W. Frey and D. P. Estes Dalton Trans., 2023, 52, 8442-8448.
Postsynthetic Transformation of Imine- into Nitrone-Linked Covalent Organic Frameworks for Atmospheric Water Harvesting at Decreased Humidity
L. Grunenberg, G. Savasci, S.T. Emmerling, F. Heck, S. Bette, A. Cima Bergesch, C. Ochsenfeld and B.V. Lotsch J. Am. Chem. Soc. 2023, 145, 24, 13241–13248.
Tethering chiral Rh diene complexes inside mesoporous solids: experimental and theoretical study of substituent, pore and linker effects on asymmetric catalysis
M. Kirchhof, K. Gugeler, A.-K. Beurer, F. R. Fischer, D. Batman, S. M. Bauch, S. Kolin, E. Nicholas, R. Schoch, Ch. Vogler, S. R. Kousik, A. Zens, B. Plietker, P. Atanasova, S. Naumann, M. Bauer, J. R. Bruckner, Y. Traa, J. Kästner and Sabine Laschat Catal. Sci. Technol., 2023, 13, 3709-3724.
Revealing the Monomer Gradient of Polyether Copolymers Prepared Using N-Heterocyclic Olefins: Metal-Free Anionic versus Zwitterionic Lewis Pair Polymerization
E. Kersten, O. Linker, J. Blankenburg, M. Wagner, P. Walther, S. Naumann and H. Frey Macromol. Chem. Phys. 2023, 2300097.
How Solid Surfaces Control Stability and Interactions of Supported Cationic CuI(dppf) Complexes─A Solid-State NMR Study
M. Schnierle, S. Klostermann, E. Kaya, Z. Li, D. Dittmann, C. Rieg, D. P. Estes, J. Kästner, M. R. Ringenberg and M. Dyballa Inorg. Chem. 2023, 62, 19, 7283–7295.
Remarkable Enhancement of Catalytic Activity of Cu-Complexes in the Electrochemical Hydrogen Evolution Reaction by Using Triply Fused Porphyrin**
S. Chandra, A. S. Hazari, Q. Song, D. Hunger, N. I. Neuman, J. van Slageren, E. Klemm and B. Sarkar ChemSusChem 2023, 16, e202201146.
Spin State in Homoleptic Iron(II) Terpyridine Complexes Influences
Mixed Valency and Electrocatalytic CO2 Reduction
S. Suhr, N. Schröter, M. Kleoff, N. Neuman, D. Hunger, R. Walter, C. Lücke, F. Stein, S. Demeshko, H. Liu, H.-U. Reissig, J. van Slageren and B. Sarkar Inorg. Chem. 2023, 62, 16, 6375-6386.
Correlative high-resolution imaging of hydrogen in Mg2Ni hydrogen storage thin films
D. Andersen, H. Chen, S. Pal, L. Cressa, O. De Castro, T. Wirtz, G. Schmitz and S. Eswara Int. J. Hydrogen Energy, 2023, 48, 37, 13943-13954.
FAIR and scalable management of small-angle X-ray scattering data
T. Giess, S. Itzigehl, J. Range, R. Schomig, J. R. Bruckner and J. Pleiss, J. Appl. Cryst. 2023, 56, 565-575.
Betainic and ionic tungsten (VI) imido alkylidene N-heterocyclic olefin complexes
M. R. Buchmeiser, D. Imbrich, D. Wang and S. Naumann J. Organomet. Chem. 2023, 991, 122674.
Comparative study of lattice parameter and pore size of ordered mesoporous silica materials using physisorption, SAXS measurements and transmission electron microscopy
A.-K. Beurer, S. Dieterich, H. Solodenko, E. Kaya, N. Merdanoǧlu, G. Schmitz, Y. Traa and J. R. Bruckner Microporous Mesoporous Mater. 2023, 354, 112508. The publication can be downloaded free of charge and without registration until May 11, 2023 via the following link: https://authors.elsevier.com/a/1gnb54xQ964rdP
Nitric Oxide (NO) as a Reagent for Topochemical Framework Transformation and Controlled NO Release in Covalent Organic Frameworks
S. T. Emmerling, J. Maschita, and B. V. Lotsch J. Am. Chem. Soc.2023, 145, 14, 7800–7809.
Ruthenium Complexes of Polyfluorocarbon Substituted Terpyridine and Mesoionic Carbene Ligands: An Interplay in CO2 Reduction
F. Stein, M. Nößler, A. S. Hazari, L. Böser, R. Walter, H. Liu, E. Klemm and B. Sarkar Chem.Eur.J. 2023, 29, e2023004.
Influence of Water Content on Speciation and Phase Formation in Zr–Porphyrin-Based MOFs
Ch. Koschnick, M. W. Terban, S. Canossa, M. Etter, R. E. Dinnebier and B. V. Lotsch Adv. Mater. 2023, 36, 2210613.
Olefin Metathesis under Spatial Confinement and Continuous Flow: Investigation of Isomeric Side Reactions with a Grubbs–Hoveyda Type Catalyst
A. Böth, T. Roider, F. Ziegler, X. Xie, M. R. Buchmeiser and U. Tallarek ChemCatChem 2023, 15, e202201268.
Stereoselective Ring-Opening Metathesis Polymerization
with Tungsten Sulfido Alkylidene N-Heterocyclic Carbene
Complexes
M. R. Buchmeiser, P. Probst, D. Wang, and P. M. Hauser Macromol. Chem. Phys. 2023, 224, 2200350.
Oxo-Bridged Zr dimers as well-defined models of oxygen vacancies on ZrO2
E. J. Wimmer, S. V. Klostermann, M. Ringenberg, J. Kästner and D. P. Estes Eur. J. Inorg. Chem. 2023, e202200709.
A Practical and Robust Zwitterionic Cooperative Lewis Acid/Acetate/Benzimidazolium Catalyst for Direct 1,4-Additions
A. C. Hans, P. M. Becker, J. Haußmann, S. Suhr, D. M. Wanner, V. Lederer, F. Willig, W. Frey, B. Sarkar, J. Kästner and R. Peters Angew. Chem. Int. Ed. 2023, 62, e202217519.
Effect of liquid confinement on regioselectivity in the hydrosilylation of alkynes with cationic Rh(i) N-heterocyclic carbene catalysts
Panyam P. K. R. and M. R. Buchmeiser Faraday Discuss., 2023, 244, 39-50.
Hydrosilylation of Alkynes Under Continuous Flow Using Polyurethane-Based Monolithic Supports with Tailored Mesoporosity
H. Acikalin, P. K. R. Panyam, A. W. Shaikh, D. Wang, S. R. Kousik, P. Atanasova and M. R. Buchmeiser Macromol. Chem. Phys. 2023, 224, 2200234.
Determination of accessibility and spatial distribution of chiral Rh diene complexes immobilized on SBA-15 via phosphine-based solid-state NMR probe molecules
C. Rieg, M. Kirchhof, K. Gugeler, A. Beurer, L. Stein, K. Dirnberger, W. Frey, J. Bruckner, Y. Traa, J. Kästner, S. Ludwigs, S. Laschat and M. Dyballa Catal. Sci. Technol., 2023,13, 410-425.
Molybdenum Alkylidyne Silyloxy N-Heterocyclic Carbene
Complexes – Highly Active Alkyne Metathesis Catalysts that
can be Handled in Air
J. V. Musso, V. Gramm, S. Stein, W. Frey and M. R. Buchmeiser Eur. J. Inorg. Chem. 2023, 26, e202200649.
Imaging the Permeability and Passivation Susceptibility of SiO2 Nanosphere-Based Mesoporous Supports for Molecular Heterogeneous Catalysis under Confinement
S. R. Kousik, F. Ziegler, D. Sipp, A. Rodríguez-Camargo, H. Solodenko, W. Gassner, G. Schmitz, B. V. Lotsch, M. R. Buchmeiser, K. Koynov and P. Atanasova ACS Appl. Nano Mater. 2022, 5, 10, 14733–14745.
Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes Confined in Mesoporous Silica: Tuning Transition States Towards Z-Selective Ring-Opening Cross-Metathesis
E. L. Goldstein, F. Ziegler, A.-K. Beurer, Y. Traa, J. R. Bruckner, M. R. Buchmeiser ChemCatChem 2022,14, e202201008.
Frozen n-Tetradecane Investigated by Cryo-Atom Probe Tomography
K. Meng, T. Schwarz, E. Weikum, P. Stender and Guido Schmitz J. Microsc. Microanal. 2022, 1-11.
Understanding the Underlying Field Evaporation Mechanism of Pure Water Tips in High Electrical Fields
N. Segreto, T. M. Schwarz, C. A. Dietrich, P. Stender, R. Schuldt, G. Schmitz, and J. Kästner J. Phys. Chem. A 2022, 126, 33, 5663–5671.
Escaping the horns of the COF dilemma
- PERSPECTIVE - L. Grunenberg, B. V. Lotsch Matter 2022, 5, 8, 2482-2484.
Introducing a Novel Method for Probing Accessibility, Local Environment, and Spatial Distribution of Oxidative Sites on Solid Catalysts Using Trimethylphosphine
C. Rieg, D. Dittmann, Z. Li, A. Kurtz, E. Kaya, S. Peters, B. Kunkel, M. Parlinska-Wojtan, S. Wohlrab, A.M. Abdel-Mageed, M. Dyballa J. Phys. Chem. C 2022, 126, 31, 13213–13223.
Status and Direction of Atom Probe Analysis of Frozen Liquids
- REVIEW/PERSPECTIVE - P. Stender, B. Gault, T. M. Schwarz, E. V. Woods, S.-H. Kim, J. Ott, L. T. Stephenson, G. Schmitz, Ch. Freysoldt, J. Kästner and A. A. El-Zoka Microsc. Microanal. 2022, 28, 4 , 1150 - 1167.
A thermalized electrokinetics model including stochastic reactions suitable for multiscale simulations of reaction-advection-diffusion systems
I. Tischler, F. Weik, R. Kaufmann M. Kuron, R. Weeber and Ch. Holm J. Comput. Sci. 2022, 63, 101770.
Predictive design of ordered mesoporous silica with well-defined, ultra-large mesopores
Ch. Vogler, S. Naumann and J. R. Bruckner Mol. Syst. Des. Eng., 2022, 7, 1318-1326.
Cationic molybdenum oxo alkylidenes stabilized by N-heterocyclic carbenes: from molecular systems to efficient supported metathesis catalysts
J. V. Musso, J. De J. Silva, M. J. Benedikter, J. Groos, W. Frey, Ch. Copéret and M. R. Buchmeiser Chem. Sci. 2022,13, 8649-8656.
Hydronium Ion and Water Complexes vs. Methanol on Solid Catalyst Surfaces: How Confinement Determines Stability and Reactivity.
Z. Li, D. Dittmann, C. Rieg, M. Benz, M. Dyballa Catal. Sci. Technol. 2022, 12, 5189-5202.
Covalent Organic Framework Nanoplates Enable Solution-Processed Crystalline Nanofilms for Photoelectrochemical Hydrogen Evolution
L. Yao, A. Rodríguez-Camargo, M. Xia, D. Mücke, R. Guntermann, Y. Liu, L. Grunenberg, A. Jiménez-Solano, S. T. Emmerling, V. Duppel, K. Sivula, T. Bein, H. Qi, U. Kaiser, M. Grätzel and B. V. Lotsch J. Am. Chem. Soc. 2022, 144, 23, 10291–10300.
Light-Driven Molecular Motors Embedded in Covalent Organic Frameworks
C. Stähler, L. Grunenberg, M. W. Terban, W. R. Browne, D. Doellerer, M. Kathan, M. Etter, B. V. Lotsch, B. L. Feringa and S. Krause Chem. Sci. 2022, 13, 8253-8264.
Isomers of Molybdenum Imido Alkylidene N‑Heterocyclic Carbene Complexes
I.Elser, R. Schowner, L. Stöhr, K. Herz, M. J. Benedikter, S. Sen, W. Frey, D. Wang, and M. R. Buchmeiser Organometallics 2022, 41, 10, 1232–1248.
Ligand Variations in Neutral and Cationic Molybdenum Alkylidyne NHC Catalysts
J. Groos, M. Koy, J. V. Musso, M. Neuwirt, T. Pham, P. M. Hauser, W. Frey, and M. R. Buchmeiser Organometallics 2022, 41, 10, 1167–1183.
Influence of layer slipping on adsorption of light gases in covalent organic frameworks: A combined experimental and computational study
C. Kessler, R. Schuldt, S. Emmerling, B. Lotsch, J. Kästner, J. Groß and N. Hansen
Microporous Mesoporous Mater. 2022, 336, 111796.
Commitment to active data and software management in large research alliances
M. R. Buchmeiser
Bausteine Forschungsdatenmanagement 2022,
DOI: 10.17192/bfdm.2022.1.8412.
Olefin-Surface Interactions: A Key Activity Parameter in Silica- Supported Olefin Metathesis Catalysts
Z. J. Berkson, M. Bernhardt, S. Schlapansky, M. J. Benedikter, M. R. Buchmeiser, G. Price, G. J. Sunley and C. Copéret JACS Au 2022, 2, 3, 777–786.
An atomistic view on the uptake of aromatic compounds by cyclodextrin immobilized on mesoporous silica
H. Kraus and N. Hansen
Adsorption 2022, 28, 125–136.
(Spectro)Electrochemistry of 3-(Pyrid-2-yl)-s-Tetrazine- or 1,2-(dihydro)pyridazine Tricarbonylrhenium(I)chloride
M. Schnierle, M. Winkler, V. Filippou, J. van Slageren, M. Ringenberg Eur. J. Inorg. Chem. 2022, e202100998.
Direct and Linker-Exchange Alcohol-Assisted Hydrothermal Synthesis of Imide-Linked Covalent Organic Frameworks
J. Maschita, T. Banerjee and B. V. Lotsch Chem. Mater. 2022, 34, 5, 2249–2258.
Confinement and Surface Sites Control Methanol Adsorbate Stability on MFI Zeolites, SBA-15, and Silica-supported Heteropoly Acid
Z. Li, D. Dittmann, C. Rieg, M. Benz and M. Dyballa Catal. Sci. Technol. 2022, 12, 2265-2277.
Asymmetric Hydroboration of Ketones by Cooperative Lewis Acid–Onium Salt Catalysis: A Quantum Chemical and Microkinetic Study to Combine Theory and Experiment
J. Heitkämper, J. Herrmann, M. Titze, S. M. Bauch, R. Peters and J. Kästner ACS Catal. 2022, 12, 2, 1497–1507.
Olefin Metathesis in Confinement: Towards Covalent Organic Framework Scaffolds for Increased Macrocyclization Selectivity
S. T. Emmerling, F. Ziegler, F. R. Fischer, R. Schoch, M. Bauer, B. Plietker, M. R. Buchmeiser and B. V. Lotsch Chem. Eur. J. 2022, 28, e202104108.
Special Issue on Contemporary Challenges in Catalysis
M. R. Buchmeiser Chem. Eur. J. 2021, 27, 16808 – 16808.
Electrochemical Characterization of Redox Probes Confined in 3D Conducting Polymer Networks
J. E. Kuhlmann, S. S. Y. Liu, K. Dirnberger, M. Zharnikov and S. Ludwigs Chem. Eur. J. 2021, 27, 17255–17263.
Spin-state control of cobalt(ii) and iron(ii) complexes with click-derived tripodal ligands through non-covalent and fluorine-specific interactions
M. Nößler, D. Hunger, F. Reichert, M. Winkler, M. Reimann, J. Klein, S. Suhr, L. Suntrup, J. Beerhues, M. Kaupp, J. van Slageren and B. Sarkar Dalton Trans. 2021, 50, 18097–18106.
Predicting Catalytic Activity from ¹³CCH Alkylidene Chemical Shift in Cationic Tungsten Oxo Alkylidene N-Heterocyclic Carbene Complexes
J. V. Musso, R. Schowner, L. Falivene, W. Frey, L. Cavallo and M. R. Buchmeiser ChemCatChem 2021, 13, 1–15.
Tungsten Sulfido Alkylidene and Cationic Tungsten Sulfido Alkylidene N-Heterocyclic Carbene Complexes
P. M. Hauser, K. Gugeler, W. Frey, J. Kästner and M. R. Buchmeiser Organometallics 2021, 40, 23, 4026–4034.
A Flavin-inspired Covalent Organic Framework for Photocatalytic Alcohol Oxidation
S. Trenker, L. Grunenberg, T. Banerjee, G. Savasci, L.M. Poller, K.I.M. Muggli, F. Haase, Ch. Ochsenfeld and B.V. Lotsch Chem. Sci. 2021, 12, 15143–15150.
The reaction of HV(CO)₄dppe with MoO₃: a well-defined model of hydrogen spillover
A. H. Almidani, M. Benz, M. Winkler, Y. Ikeda, B. Grabowski, J. van Slageren and D. P. Estes Catal. Sci. Technol. 2021, 11, 7540–7544.
Influence of the Template Removal Method on the Mechanical Stability of SBA-15
A.-K. Beurer, J. R. Bruckner and Y. Traa ChemistryOpen 2021, 10, 1123 – 1128.
Rh(I)/(III)-N-Heterocyclic Carbene Complexes: Effect of Steric Confinement Upon Immobilization on Regio- and Stereoselectivity in the Hydrosilylation of Alkynes
P. K. R. Panyam, B. Atwi, F. Ziegler, W. Frey, M. Nowakowski, M. Bauer and M. R. Buchmeiser Chem. Eur. J. 2021, 27, 17220–1722.
How charge trapping affects the conductivity of electrochemically doped poly(3-hexylthiophene) films
L.-S. Hornberger, D. Neusser, C. Malacrida, L. G. Kaake and S. Ludwigs Appl. Phys. Lett. 2021, 119, 163301.
Interplay of Polarity and Confinement in Asymmetric Catalysis with Chiral Rh Diene Complexes in Microemulsions
M. Kirchhof, K. Abitaev, A. Abouhaileh, K. Gugeler, W. Frey, A. Zens, J. Kästner, T. Sottmann and S. Laschat Chem. Eur. J. 2021, 27, 16853–16870.
Mackinawite formation from elemental iron and sulfur
R. Bolney, M. Grosch, M. Winkler, J. van Slageren, W. Weigand and Ch. Robl RSC Adv. 2021, 11, 32464–32475.
Cationic Tungsten Imido Alkylidene N-Heterocyclic Carbene Complexes That Contain Bulky Ligands
R. Schowner, J. V. Musso, W. Frey, and M. R. Buchmeiser Organometallics 2021, 40, 3145–3157.
Cationic tungsten imido alkylidene N-heterocyclic carbene complexes for stereospecific ring-opening metathesis polymerization of norbornene derivatives†
J. V. Musso, M. Benedikter, P. Gebel, V. Gramm, D. Wang, R. Schowner and M. R. Buchmeiser Polym. Chem., 2021, 12, 5979–5985.
A Hard Templating Approach to Functional Mesoporous Poly(norborn-2-ene)-Based Monolithic Supports
H. Acikalin, F. Ziegler, D. Wang and M. R. Buchmeiser Macromol. Chem. Phys. 2021, 222, 2100247.
Interlayer Interactions as Design Tool for Large-Pore COFs
S. T. Emmerling, R. Schuldt, S. Bette, L. Yao, R. E. Dinnebier, J. Kästner, and B. V. Lotsch J. Am. Chem. Soc. 2021, 143, 15711–15722.
Confinement Effects for Efficient Macrocyclization Reactions with Supported Cationic Molybdenum Imido Alkylidene N‑Heterocyclic Carbene Complexes
F. Ziegler, H. Kraus, M. J. Benedikter, D. Wang, J. R. Bruckner, M. Nowakowski, K. Weißer, H. Solodenko, G. Schmitz, M. Bauer, N. Hansen and M. R. Buchmeiser ACS Catal. 2021, 11, 11570-11578.
Defying Thermodynamics: Stabilization of Alane Within Covalent Triazine Frameworks for Reversible Hydrogen Storage
V. Stavila, S. Li, C. Dun, M.A.T. Marple, H.E. Mason, J.L. Snider, J.E. Reynolds III, F. El Gabaly, J.D. Sugar, C.D. Spataru, X. Zhou, B. Dizdar, E.H. Majzoub, R. Chatterjee, J. Yano, H. Schlomberg, B.V. Lotsch, J.J. Urban, B.C. Wood and M.D. Allendorf Angew. Chem. Int. Ed. 2021, 60, 25815–25824.
Quantitative Distinction between Noble Metals Located in Mesopores from Those on the External Surface
C. Rieg, D. Dittmann, Z. Li, R. Lawitzki, K. Gugeler, S. Maier, G. Schmitz, J. Kästner, D. P. Estes and M. Dyballa Chem. Eur. J. 2021, 27, 17012-17023.
Probing the Interactions of Immobilized Ruthenium Dihydride Complexes with Metal Oxide Surfaces by MAS NMR: Effects on CO₂ Hydrogenation
H.- H. Nguyen, Z. Li, T. Enenkel, J. Hildebrand, M. Bauer, M. Dyballa and D. P. Estes J. Phys. Chem. C 2021, 125, 14627–14635.
Adsorption of light gases in covalent organic frameworks: comparison of classical density functional theory and grand canonical Monte Carlo simulations
C. Kessler, J. Eller, J. Groß and N. Hansen Microporous Mesoporous Mater. 2021, 111263.
In situ monitoring of mechanochemical covalent organic framework formation reveals templating effect of liquid additive
S. T. Emmerling, L. S. Germann, P. A. Julien, I. Moudrakovski, M. Etter, T. Friščić, R. E. Dinnebier and B. V. Lotsch Chem. 2021, 7, 6, 1639-1652.
3D Sub-Nanometer Analysis of Glucose in an Aqueous Solution by Cryo-Atom Probe Tomography
T. M. Schwarz, C. Dietrich, J. Ott, E. M. Weikum, R. Lawitzki, H. Solodenko, E. Hadjixenophontos, B. Gault, J. Kästner, G. Schmitz and P. Stender Sci. Rep. 2021, 11, 11607.
[(η6-p-Cymene)[3-(pyrid-2-yl)-1,2,4,5-tetrazine]chlororuthenium(II)]+, Redox Noninnocence and Dienophile Addition to Coordinated Tetrazine
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M. Schnierle, M. Leimkühler and M. R. Ringenberg Inorg. Chem. 2021, 60, 6367–6374.
The alumination mechanism of porous silica materials and properties of derived ion exchangers and acid catalysts
Z. Li, M. Benz, C. Rieg, D. Dittmann, A.-K. Beurer, D. Häussermann, B. Arstad and M. Dyballa Mater. Chem. Front. 2021, 5, 4254-4271.
Highly Reactive Cationic Molybdenum Alkylidyne N-Heterocyclic Carbene Catalysts for Alkyne Metathesis
J. Groos, P. M. Hauser, M. Koy, W. Frey and M. R. Buchmeiser
Organometallics 2021, 40, 8, 1178–1184.
Phase behaviour of alkynyl-terminated bicyclo[3.3.0]octa-1,4-diene ligands: a serendipitous discovery of novel calamitic liquid crystals
![Phase behaviour of alkynyl-terminated bicyclo[3.3.0]octa-1,4-diene ligands: a serendipitous discovery of novel calamitic liquid crystals](https://www.crc1333.de/wp-content/uploads/2021/04/PUB-Laschat.jpg)
F. Schulz, M. Deimling and S. Laschat Liquid Crystals 2021, 1891478.
Strategies for Pore-Diameter Control in Mesoporous Carbons Derived from Organic Self-Assembly Processes
- REVIEW - S. Naumann Organic Materials 2021, 3, 283–294.
Cationic Tungsten Oxo Alkylidene N‑Heterocyclic Carbene Complexes via Hydrolysis of Cationic Alkylidyne Progenitors
P. M. Hauser, J. V. Musso, W. Frey and M. R. Buchmeiser Organometallics 2021, 40, 927–937.
Mechanisms and Intermediates in the True Liquid Crystal Templating Synthesis of Mesoporous Silica Materials
J. R. Bruckner, J. Bauhof, J. Gebhardt, A.-K. Beurer, Y. Traa and F. Giesselmann J. Phys. Chem. B 2021, 125, 3197–3207.
Efficient and Spatially Controlled Functionalization of SBA‐15 and Initial Results in Asymmetric Rh‐Catalyzed 1,2‐Additions under Confinement
A.-K. Beurer, M. Kirchhof, J. Bruckner, W. Frey, A. Baro, M. Dyballa, F. Gießelmann, S. Laschat and Y. Traa ChemCatChem 2021, 13, 2407 – 2419.
Ordered Mesoporous Carbons via Self-Assembly of Tailored Block Copolyethers for Pore Size-Dependent Applications
F. Markus, Ch. Vogler, J. R. Bruckner and Stefan Naumann ACS Appl. Nano Mater. 2021, 4, 3486–3492.
Electrochemical Reduction Mechanism of [(η5-C5H5)Fe(dppf)(CO)]+ (dppf = 1,1′-Bis(diphenylphosphino)ferrocene)
![Electrochemical Reduction Mechanism of [(η5-C5H5)Fe(dppf)(CO)]+ (dppf = 1,1′-Bis(diphenylphosphino)ferrocene)](https://www.crc1333.de/wp-content/uploads/2021/03/Pub_Ringenberg.jpg)
Y. Pan, M. Schnierle, D. Auweiler and M. R. Ringenberg Organometallics 2021, 40, 6, 760–765.
Hierarchical Silica Inverse Opals as a Catalyst Support for Asymmetric Molecular Heterogeneous Catalysis with Chiral Rh‐diene Complexes
M. Deimling, S. R. Kousik, K. Abitaev, W. Frey, T. Sottmann, K. Koynov, S. Laschat and P. Atanasova ChemCatChem 2021, 13, 1 –12.
Amine-Linked Covalent Organic Frameworks as a Platform for Postsynthetic Structure Interconversion and Pore-Wall Modification
L. Grunenberg, G. Savasci, M. W. Terban, V. Duppel, I. Moudrakovski, M. Etter, R. E. Dinnebier, Ch. Ochsenfeld and B. V. Lotsch J. Am. Chem. Soc. 2021, 143, 3430-3438.
Olefin Ring‐closing Metathesis under Spatial Confinement and Continuous Flow
F. Ziegler, T. Roider, M. Pyschik, Ch. P. Haas, D. Wang, U. Tallarek and M. R. Buchmeiser ChemCatChem 2021, 13, 1–9.
Electronic Structure of a Diiron Complex: A Multitechnique Experimental Study of [(dppf)Fe(CO) ₃] ⁺/⁰
![Electronic Structure of a Diiron Complex: A Multitechnique Experimental Study of [(dppf)Fe(CO) ₃] ⁺/⁰](https://www.crc1333.de/wp-content/uploads/2021/02/PUB-Slagaren_1.jpeg)
M. Winkler, M. Schnierle, F. Ehrlich, K. I. Mehnert, D. Hunger, A. M. Sheveleva, L. Burkhardt, M. Bauer, F. Tuna, M. R. Ringenberg and J. van Slageren Inorg. Chem. 2021, 60, 2856–2865.
PoreMS: a software tool for generating silica pore models with user-defined surface functionalisation and pore dimensions
H. Kraus, J. Rybka, A. Höltzel, N. Trebel, U. Tallarek and N. Hansen Mol. Simul. 2021, 47, 306-316.
Adsorption of azide-functionalized thiol linkers on zinc oxide surfaces
P. Atanasova, M. Dou, S. R. Kousik, J. Bill and M. Fyta RSC Adv. 2021, 11, 5466-5478.
From Macro to Mesoporous ZnO Inverse Opals: Synthesis, Characterization and Tracer Diffusion Properties
S. R. Kousik, D. Sipp, K. Abitaev, Y. Li, T. Sottmann, K. Koynov and P. Atanasova Nanomaterials 2021, 11, 196.
Tuning the Latent Behavior of Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes in Dicyclopentadiene Polymerization
M. Momin, J. V. Musso, W. Frey and M. R. Buchmeiser Organometallics 2021, 40, 253-265.
Catalysis in Confined Spaces
- EDITORIAL - M. R. Buchmeiser, Editorial to the Special Collection „Catalysis in Confined Spaces“ ChemCatChem 2021, 13, 1 – 3.
A Method for the Selective Quantification of Brønsted Acid Sites on External Surfaces and in Mesopores of Hierarchical Zeolites
C. Rieg, Z. Li, A. Kurtz, M. Schmidt, D. Dittmann, M. Benz and M. Dyballa J. Phys. Chem. C 2021, 125, 515–525.
A simplified approach for the metal-free polymerization of propylene oxide
RSC Adv. 2020, 10, 43389–43393.
The Presence of a Wall Enhances the Probability for Ring‐Closing Metathesis: Insights from Classical Polymer Theory and Atomistic Simulations
Adjustable polystyrene nanoparticle templates for the production of mesoporous foams and ZnO inverse opals
K. Abitaev, Y. Qawasmi, P. Atanasova, C. Dargel, J. Bill, T. Hellweg and T. Sottmann Colloid Polym. Sci. 2021, 299, 243–258.
Charge Distribution in Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes: A Combined X-ray, XAS, XES, DFT, Mössbauer, and Catalysis Approach
M. J. Benedikter, J. V. Musso, M. K. Kesharwani, K. L. Sterz, I. Elser, F. Ziegler, F. Fischer, B. Plietker, W. Frey, J. Kästner, M. Winkler, J. van Slageren, M. Nowakowski, M. Bauer and M. R. Buchmeiser ACS Catal. 2020, 10, 14810–14823.
Ruthenium‐Catalyzed Secondary Amine Formation Studied by Density Functional Theory
L. Hückmann, S. Álvarez‐Barcia, M. Fuhrer, B. Plietker and J. Kästner ChemCatChem 2021, 13, 1383 –1388.
Field evaporation and atom probe tomography of pure water tips
T. M. Schwarz, E. M. Weikum, K. Meng, E. Hadjixenophontos, C. A. Dietrich, J. Kästner, P. Stender and G. Schmitz Sci. Rep. 2020, 10, 20271.
Solving the COF trilemma: towards crystalline, stable and functional covalent organic frameworks
- REVIEW - F. Haase and B. V. Lotsch Chem. Soc. Rev. 2020, 49, 8469-8500.
Polymer photocatalysts for solar-to-chemical energy conversion
- REVIEW - T. Banerjee, F. Podjaski, J. Kröger, B. P. Biswal and Bettina V. Lotsch Nat. Rev. Mater. 2021, 6, 168–190.
Confined Ru‐catalysts in a Two‐phase Heptane/Ionic Liquid Solution: Modeling Aspects
T. Kobayashi, H. Kraus, N. Hansen and M. Fyta ChemCatChem 2021, 13, 739– 746.
Effect of aluminum and sodium on the sorption of water and methanol in microporous MFI-type zeolites and mesoporous SBA-15 materials
Z. Li, C. Rieg, A. K. Beurer, M. Benz, J. Bender, Ch. Schneck, Y. Traa, M. Dyballa and M. Hunger Adsorption 2021, 27, 49–68.
Cationic Group VI Metal Imido Alkylidene N-Heterocyclic Carbene Nitrile Complexes: Bench-Stable, Functional Group Tolerant Olefin Metathesis Catalysts
M. J. Benedikter, J. V. Musso, W. Frey, R. Schowner and M. R. Buchmeiser Angew. Chem. Int. Ed. 2021, 60, 1374-1382.
Olefin Ring‐closing Metathesis under Spatial Confinement: Morphology−Transport Relationships
U. Tallarek, J. Hochstrasser, F. Ziegler, X. Huang, Ch. Kübel and M. R. Buchmeiser ChemCatChem 2021, 13, 281-292.
Silica-Supported Cationic Tungsten Imido Alkylidene Stabilized by an NHeterocyclic Carbene Ligand Boosts Activity and Selectivity in the Metathesis of α-Olefins
J. De Jesus Silva, D. Mance, M. Pucino, M. J. Benedikter, I. Elser, M. R. Buchmeiser and Ch. Copéret Helv. Chim. Acta 2020, 103, e2000161.
Towards highly conducting bicarbazole redox polymer films with plateau-like conductivities
C. Malacrida, Y. Lu, K. Dirnberger, S. Gámez-Valenzuela, M. C. Ruiz Delgado and S. Ludwigs J. Mater. Chem. C 2020, 8, 15393-15405.
Evaporation and Fragmentation of Organic Molecules in Strong Electric Fields Simulated with DFT
C. A. Dietrich, R. Schuldt, D. Born, H. Solodenko, G. Schmitz and J. Kästner J. Phys. Chem. A 2020, 124, 8633–8642.
Tetrazine metallation boosts rate and regioselectivity of inverse electron demand Diels–Alder (iEDDA) addition of dienophiles
M. Schnierle, S. Blickle, V. Filippou and M. R. Ringenberg Chem. Commun. 2020, 56, 12033-12036.
Hierarchically Structured Spherulitic Cobalt Hydroxide Carbonate as a Precursor to Ordered Nanostructures of Electrocatalytically Active Co₃O₄
A. S. Schenk, M. Goll, L. Reith, M. Roussel, B. Blaschkowski, S. Rosenfeldt, X. Yin, W. Schmahl and S. Ludwigs Cryst. Growth Des. 2020, 20, 6407–6420.
Noble metal location in porous supports determined by reaction with phosphines
C. Rieg, D. Dittmann, Z. Li, A. Kurtz, I. Lorenz, D. P. Estes, M. R. Buchmeiser, M. Dyballa and M. Hunger Microporous Mesoporous Mater. 2020, 310, 110594.
Experimental and Theoretical Study on the Role of Monomeric vs Dimeric Rhodium Oxazolidinone Norbornadiene Complexes in Catalytic Asymmetric 1,2- and 1,4-Additions
M. Kirchhof, K. Gugeler, F. R. Fischer, M. Nowakowski, A. Bauer, S. Alvarez-Barcia, K. Abitaev, M. Schnierle, Y. Qawasmi, W. Frey, A. Baro, D. P. Estes, T. Sottmann, M. R. Ringenberg, B. Plietker, M. Bauer, J. Kästner and S. Laschat Organometallics 2020, 39, 3131–3145.
Adventures and Detours in the Synthesis of Hydropentalenes
M. Deimling, A. Zens, N. Park, Ch. Hess, S. Klenk, Z. Dilruba, A. Baro and S. Laschat Synlett 2021, 32, 119-139.
Synthesis of Tungsten(VI) Imido Alkylidene Bispyrrolide Complexes via the Isocyanate Route
J. V. Musso, M. J. Benedikter, P. Gebel, I. Elser, W. Frey and M. R. Buchmeiser Organometallics 2020, 39, 3072–3076.
Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Catalyst
M. K. Kesharwani, I. Elser, J. V. Musso, M. R. Buchmeiser and J. Kästner Organometallics 2020, 39, 3146–3159.
Group 6 metal alkylidene and alkylidyne N-heterocyclic carbene complexes for olefin and alkyne metathesis
- REVIEW - M. J. Benedikter, F. Ziegler, J. Groos, P. M. Hauser, R. Schowner and M. R. Buchmeiser Coord. Chem. Rev. 2020, 415, 213315.
High Conductivities of Disordered P3HT films by an Electrochemical Doping Strategy
D. Neusser, C. Malacrida, M. Kern, Y. Gross, J. van Slageren and S. Ludwigs Chem. Mater. 2020, 32, 6003–6013.
Total scattering reveals the hidden stacking disorder in a 2D covalent organic framework
A. M. Pütz, M. W. Terban, S. Bette, F. Haase, R. E. Dinnebier and B. V. Lotsch Chem. Sci. 2020, 11, 12647–12654
Chromium (VI) Bisimido Dichloro, Bisimido Alkylidene and Chromium (V) Bisimido Iodo N-Heterocyclic Carbene Complexes
P. K. R. Panyam, L. Stöhr, D. Wang, W. Frey and M. R. Buchmeiser Eur. J. Inorg. Chem. 2020, 3673-3681.
Ionothermal Synthesis of Imide‐Linked Covalent Organic Frameworks
J. Maschita, T. Banerjee, G. Savasci, F. Haase, Ch. Ochsenfeld and B. V. Lotsch Angew. Chem. Int. Ed. 2020, 59, 15750-15758.
Rational Design of Covalent Cobaloxime-COF Hybrids for Enhanced Photocatalytic Hydrogen Evolution
K. Gottschling, G. Savasci, H. A. Vignolo-González, S. Schmidt, P. Mauker, T. Banerjee, P. Rovó, Ch. Ochsenfeld and B. V. Lotsch J. Am. Chem. Soc. 2020, 142, 12146–12156.
Cationic Tungsten Alkylidyne N‑Heterocyclic Carbene Complexes: Synthesis and Reactivity in Alkyne Metathesis
P. M. Hauser, M. van der Ende, J. Groos, W. Frey, D. Wang and M. R. Buchmeiser Eur. J. Inorg. Chem. 2020, 3070-3082.
Metal‐Surface Interactions and Surface Heterogeneity in ‘Well‐Defined’ Silica‐Supported Alkene Metathesis Catalysts: Evidences and Consequences
M. Pucino, W.‐C. Liao, K. W. Chan, E. Lam, R. Schowner, P. A. Zhizhko, M. R. Buchmeiser and C. Copéret Helv. Chim. Acta 2020, 103, e2000072.
Reversible N‐ Heterocyclic Carbene‐Induced α‐H Abstraction in Tungsten(VI) Imido Dialkyl Dialkoxide Complexes
J. V. Musso, M. J. Benedikter, D. Wang, W. Frey, H. J. Altmann and M. R. Buchmeiser Chem. Eur. J. 2020, 26, 8709-8713.
Computational Study of Confinement Effects in Molecular Heterogeneous Catalysis
H. Kraus, J. Rybka, U. Tallarek, N.Hansen
High Performance Computing in Science and Engineering '20 2020
Controlled Synthesis of “Reverse Pluronic”-Type Block Copolyethers with High Molar Masses for the Preparation of Hydrogels with Improved Mechanical Properties
F. Markus, J. R. Bruckner and S. Naumann Macromol. Chem. Phys.2020, 221, 1900437.
Extracting the shape of nanometric field emitters
D. Beinke, F. Bürger, H. Solodenko, R. Acharya, H. Klauk and G. Schmitz Nanoscale 2020, 12, 2820–2832.
Origin and Use of Hydroxyl Group Tolerance in Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Catalysts
R. Schowner, I. Elser, M. J. Benedikter, M. Momin, W. Frey, T. Schneck, L. Stöhr and M. R. Buchmeiser Angew. Chem. Int. Ed. 2020, 59, 951-958.
Olefin Metathesis in Confined Geometries: A Biomimetic Approach toward Selective Macrocyclization
F. Ziegler, J. Teske, I. Elser, M. Dyballa, W. Frey, H. Kraus, N. Hansen, J. Rybka, U. Tallarek and M.R. Buchmeiser J. Am. Chem. Soc. 2019, 141, 19014-19022.
Stereoselective Olefin Ring-Opening Cross Metathesis Catalyzed by Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes
M. Momin, G. M. Nagy and M. R. Buchmeiser Adv. Synth. Catal. 2019, 361, 5596-5604.
Electrochemical Manipulation of Aligned Block Copolymer Templates
- REVIEW - S. S. Y. Liu and S. Ludwigs Macromol. Rapid Commun. 2020, 41, 1900485.
Molybdenum and Tungsten Alkylidyne Complexes Containing Mono- and Bidentate N-Heterocyclic Carbenes
I. Elser, J. Groos, P. M. Hauser, M. Koy, M. van der Ende, D. Wang, W. Frey, K. Wurst, J. Meisner, J. Kästner and M. R. Buchmeiser Organometallics 2019, 38, 4133−4146.
Potential of triphenylphosphine as solid-state NMR probe for studying the noble metal distribution on porous supports
M. Dyballa, C. Rieg, D. Dittmann, Z. Li, M. R. Buchmeiser, B. Plietker and M. Hunger Microporous Mesoporous Mater. 2020, 293, 109778.
Regio- and Stereospecific Cyclopolymerization of α,ω-Diynes by Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes
P. Probst, I. Elser, R. Schowner, M. J. Benedikter and M. R. Buchmeiser Macromol. Rapid Commun. 2020, 41, 1900398.
Sustained Solar H₂ Evolution from a Thiazolo[5,4-d]thiazole-Bridged Covalent Organic Framework and Nickel-Thiolate Cluster in Water
![Sustained Solar H₂ Evolution from a Thiazolo[5,4-d]thiazole-Bridged Covalent Organic Framework and Nickel-Thiolate Cluster in Water](https://www.crc1333.de/wp-content/uploads/2020/07/Publikation_Lotsch_1.jpeg)
B. P. Biswal, H. A. Vignolo-González, T. Banerjee, L. Grunenberg, G. Savasci, K. Gottschling, J. Nuss, Ch. Ochsenfeld and B. V. Lotsch J. Am. Chem. Soc. 2019, 141, 11082–11092.
Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes Containing Pyrrolide Ligands: Access to Catalysts with Sterically Demanding Alkoxides
I. Elser, M. J. Benedikter, R. Schowner, W. Frey, D. Wang and M. R. Buchmeiser Organometallics 2019, 38, 2461-2471.
Synthesis of trans-Isotactic Poly(norbornene)s through Living Ring-Opening Metathesis Polymerization Initiated by Group VI Imido Alkylidene N-Heterocyclic Carbene Complexes
M. J. Benedikter, R. Schowner, I. Elser, P. Werner, K. Herz, L. Stöhr, D. A. Imbrich, G. M. Nagy, D. Wang and M. R. Buchmeiser Macromolecules 2019, 52, 4059-4066.
Lewis Pair Polymerization of Epoxides via Zwitterionic Species as a Route to High‐Molar‐Mass Polyethers
P. Walther, A. Krauß and S. Naumann Angew. Chem. Int. Ed.2019, 58, 10737–10741.
Asymmetric Catalysis in Liquid Confinement: Probing the Performance of Novel Chiral Rhodium Diene Complexes in Microemulsions and Conventional Solvents
M. Deimling, M. Kirchhof, B. Schwager, Y. Qawasmi, A. Savin, T. Mühlhäuser, W. Frey, B. Claasen, A. Baro, T. Sottmann and S. Laschat Chem. Eur. J. 2019, 25, 9464-9476.
Please find the submitted version of the article on the homepage of the Laschat-group.
Mechanism of Olefin Metathesis with Neutral and Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes
K. Herz, M. Podewitz, L. Stöhr, D. Wang, W. Frey, K. R. Liedl, S. Sen and M. R. Buchmeiser J. Am. Chem. Soc. 2019, 141, 8264-8276.
Understanding Synthetic Peculiarities of Cationic Molybdenum (VI) Imido Alkylidene N-Heterocyclic Carbene Complexes
R. Schowner, W. Frey and M. R. Buchmeiser Eur. J. Inorg. Chem. 2019, 1911-1922.
Rotational barriers of carbamate-protected amine crosslinkers for hydrogels: A combined experimental and computational study
N. Schädel, J. Gebhardt, M. Löffler, D. Garnier, N. Hansen and S. Laschat J. Phys. Org. Chem. 2019, 32, e3936.
Proton Affinities of N-Heterocyclic Olefins and Their Implications for Organocatalyst Design
R. Schuldt, J. Kästner and S. Naumann J. Org. Chem. 2019, 84, 2209–2218.
Phase Behavior and Microstructure of Symmetric Nonionic Microemulsions with Long-Chain n-Alkanes and Waxes
K. Schneider, T. M. Ott, R. Schweins, H. Frielinghaus, O. Lade and T. Sottmann Ind. Eng. Chem. Res. 2019, 58, 2583-2595.
Promoting Terminal Olefin Metathesis with a Supported Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Catalyst
M. Pucino, M. Inoue, C. P. Gordon, R. Schowner, L. Stöhr, S. Sen, C. Hegedüs, E. Robé, F. Tóth, M. R. Buchmeiser and C. Copéret Angew. Chem. Int. Ed. 2018, 57, 4566–14569
. .Synthesis of nanoporous organic/inorganic hybrid materials with adjustable pore size
Y. Qawasmi, P. Atanasova, T. Jahnke, Z. Burghard, A. Müller, L. Grassberger, R. Strey, J. Bill and T. Sottmann Colloid. Polym. Sci. 2018, 296, 1805-1816.
Functional Precision Polymers via Stereo- and Regioselective Polymerization Using Group 6 Metal Alkylidene and Group 6 and 8 Metal Alkylidene N-Heterocyclic Carbene Complexes
- FEATURE ARTICLE - M. R. Buchmeiser Macromol. Rapid Commun. 2019, 40, 1800492.
Molybdenum Imido, Tungsten Imido and Tungsten Oxo Alkylidene N-Heterocyclic Carbene Olefin Metathesis Catalysts
- CONCEPT - M. R. Buchmeiser Chem. Eur. J. 2018, 24, 14295-14301.