Please note that LibreCat no longer supports Internet Explorer versions 8 or 9 (or earlier).
We recommend upgrading to the latest Internet Explorer, Google Chrome, or Firefox.
1252 Publications
2020 | Journal Article | LibreCat-ID: 17374
Ibaceta-Jaña, Josefa, Ruslan Muydinov, Pamela Rosado, Hossein Mirhosseini, Manjusha Chugh, Olga Nazarenko, Dmitry N. Dirin, et al. “Vibrational Dynamics in Lead Halide Hybrid Perovskites Investigated by Raman Spectroscopy.” Phys. Chem. Chem. Phys. 22 (2020): 5604–14. https://doi.org/10.1039/C9CP06568G.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 17376
Schöppe, Philipp, Sven Schönherr, Manjusha Chugh, Hossein Mirhosseini, Philip Jackson, Roland Wuerz, Maurizio Ritzer, et al. “Revealing the Origin of the Beneficial Effect of Cesium in Highly Efficient Cu(In,Ga)Se2 Solar Cells.” Nano Energy 71 (2020): 104622. https://doi.org/10.1016/j.nanoen.2020.104622.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 23855
Aly, Kamal I., Jingjiang Sun, Dirk Kuckling, and Osama Younis. “Polyester Resins Based on Soybean Oil: Synthesis and Characterization.” Journal of Polymer Research 27 (2020). https://doi.org/10.1007/s10965-020-02244-9.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 23852
Li, Jie, Chendong Ji, Baozhong Lü, Maksim Rodin, Jan Paradies, Meizhen Yin, and Dirk Kuckling. “Dually Crosslinked Supramolecular Hydrogel for Cancer Biomarker Sensing.” ACS Applied Materials & Interfaces 12, no. 33 (2020): 36873–81. https://doi.org/10.1021/acsami.0c08722.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 23849
Berg, Patrik, Franziska Obst, David Simon, Andreas Richter, Dietmar Appelhans, and Dirk Kuckling. “Novel Application of Polymer Networks Carrying Tertiary Amines as a Catalyst Inside Microflow Reactors Used for Knoevenagel Reactions.” European Journal of Organic Chemistry, 2020, 5765–74. https://doi.org/10.1002/ejoc.202000978.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 23848
Berg, Marie-Theres, Chiel Mertens, Filip Du Prez, Thomas D. Kühne, Artjom Herberg, and Dirk Kuckling. “Analysis of Sequence-Defined Oligomers through Advanced Polymer ChromatographyTM – Mass Spectrometry Hyphenation.” RSC Advances 10 (2020): 35245–52. https://doi.org/10.1039/d0ra06419j.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 23847
Yu, Xiaoqian, Artjom Herberg, and Dirk Kuckling. “Micellar Organocatalysis Using Smart Polymer Supports: Influence of Thermoresponsive Self-Assembly on Catalytic Activity.” Polymers 12, no. 10 (2020). https://doi.org/10.3390/polym12102265.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 23856
Berg, Patrik, Carsten Dieter Prowald, and Dirk Kuckling. “Investigation of Gel Properties of Novel Cryo-Clay-Silica Polymer Networks.” Gels 6, no. 2 (2020). https://doi.org/10.3390/gels6020011.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 34643
Liphardt, L., K. Suematsu, and Guido Grundmeier. “Kinetic Studies of Cathode Degradation on PEM Fuel Cell Short Stack Level Undergoing Freeze Startups with Different States of Residual Water and Current Draws.” International Journal of Hydrogen Energy 46, no. 5 (2020): 4399–4406. https://doi.org/10.1016/j.ijhydene.2020.10.273.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 33646
Majumdar, I., S.K. Sahoo, V. Parvan, Hossein Mirhosseini, B. Chacko, Y. Wang, D. Greiner, Thomas Kühne, R. Schlatmann, and I. Lauermann. “Effects of KF and RbF Treatments on Cu(In,Ga)Se2-Based Solar Cells: A Combined Photoelectron Spectroscopy and DFT Study.” Applied Surface Science 538 (2020). https://doi.org/10.1016/j.apsusc.2020.148085.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 33647
Kossmann, Janina, Diana Piankova, Nadezda V. Tarakina, Julian Joachim Heske, Thomas Kühne, Johannes Schmidt, Markus Antonietti, and Nieves López-Salas. “Guanine Condensates as Covalent Materials and the Concept of Cryptopores.” Carbon 172 (2020): 497–505. https://doi.org/10.1016/j.carbon.2020.10.047.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 35328
Wortmann, Martin, Natalie Frese, Waldemar Keil, Johannes Brikmann, Jan Biedinger, Bennet Brockhagen, Günter Reiss, et al. “The Deterioration Mechanism of Silicone Molds in Polyurethane Vacuum Casting.” ACS Applied Polymer Materials 2, no. 11 (2020): 4719–32. https://doi.org/10.1021/acsapm.0c00744.
LibreCat
| DOI
2020 | Conference (Editor) | LibreCat-ID: 35618
Fechner, Sabine, and Roald Verhoeff, eds. Science Teaching Processes (Strand 3). In Levrini, O. & Tasquier, G. (Eds.), The Beauty and Pleasure of Understanding: Engaging with Contemporary Challenges through Science Education. Electronic Proceedings of the ESERA 2019 Conference. . Bologna: University of Bologna, 2020.
LibreCat
2020 | Journal Article | LibreCat-ID: 16301 | 
Atorf, Bernhard, Holger Mühlenbernd, Thomas Zentgraf, and Heinz-Siegfried Kitzerow. “All-Optical Switching of a Dye-Doped Liquid Crystal Plasmonic Metasurface.” Optics Express 28, no. 6 (2020): 8898–8908. https://doi.org/10.1364/oe.383877.
LibreCat
| DOI
| Download (ext.)
2020 | Journal Article | LibreCat-ID: 22534
Schwiderek, Sabrina, Alejandro G. Orive, Soheil Karimi Aghda, Jochen M. Schneider, Maria Teresa de los Arcos de Pedro, and Guido Grundmeier. “Single-Molecule Desorption Studies of Poly(Acrylic Acid) at Electrolyte/Oxide/TiAlN Interfaces.” Langmuir, 2020, 9489–98. https://doi.org/10.1021/acs.langmuir.0c00188.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 22537
Hoppe, C, F Mitschker, M Butterling, M O Liedke, Maria Teresa de los Arcos de Pedro, P Awakowicz, A Wagner, and Guido Grundmeier. “Characterisation of Micropores in Plasma Deposited SiO x Films by Means of Positron Annihilation Lifetime Spectroscopy.” Journal of Physics D: Applied Physics, 2020. https://doi.org/10.1088/1361-6463/aba8ba.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 22536
Knust, Steffen, Andreas Kuhlmann, Alejandro G. Orive, Maria Teresa de los Arcos de Pedro, and Guido Grundmeier. “Influence of Dielectric Barrier Plasma Treatment of ZnMgAl Alloy‐coated Steel on the Adsorption of Organophosphonic Acid Monolayers.” Surface and Interface Analysis, 2020, 1077–82. https://doi.org/10.1002/sia.6782.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 35869
Keum, Changmin, David Becker, Emily Archer, Harald Bock, Heinz-Siegfried Kitzerow, Malte C. Gather, and Caroline Murawski. “Organic Light‐Emitting Diodes Based on a Columnar Liquid‐Crystalline Perylene Emitter.” Advanced Optical Materials 8, no. 17 (2020). https://doi.org/10.1002/adom.202000414.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 35859
Risse, Anna Margareta, Jürgen Schmidtke, and Heinz-Siegfried Kitzerow. “Dynamics of a Liquid Crystal-Based Modulator with Germanium Substrates for Mid-Infrared Radiation.” Liquid Crystals 48, no. 7 (2020): 1025–33. https://doi.org/10.1080/02678292.2020.1839803.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 37956
Andexer, Jennifer N., Uwe Beifuss, Florian Beuerle, Malte Brasholz, Rolf Breinbauer, Martin Ernst, Julian Greb, et al. “Organische Chemie.” Nachrichten Aus Der Chemie 68, no. 3 (2020): 42–72. https://doi.org/10.1002/nadc.20204095515.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 37951
Liu, Xin, Lars Longwitz, Brian Spiegelberg, Jan Tönjes, Torsten Beweries, and Thomas Werner. “Erbium-Catalyzed Regioselective Isomerization–Cobalt-Catalyzed Transfer Hydrogenation Sequence for the Synthesis of Anti-Markovnikov Alcohols from Epoxides under Mild Conditions.” ACS Catalysis 10, no. 22 (2020): 13659–67. https://doi.org/10.1021/acscatal.0c03294.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 37952
Grandane, Aiga, Alessio Nocentini, Thomas Werner, Raivis Zalubovskis, and Claudiu T. Supuran. “Benzoxepinones: A New Isoform-Selective Class of Tumor Associated Carbonic Anhydrase Inhibitors.” Bioorganic and Medicinal Chemistry 28, no. 11 (2020). https://doi.org/10.1016/j.bmc.2020.115496.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 37953
Hu, Yuya, Sandra Peglow, Lars Longwitz, Marcus Frank, Jan Dirk Epping, Volker Brüser, and Thomas Werner. “Plasma‐Assisted Immobilization of a Phosphonium Salt and Its Use as a Catalyst in the Valorization of CO 2.” ChemSusChem 13, no. 7 (2020): 1825–33. https://doi.org/10.1002/cssc.201903384.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 37949
Stefanow, Vivian, Aiga Grandane, Marcus Eh, Johannes Panten, Anke Spannenberg, and Thomas Werner. “Stereoselective Synthesis of a Cis-Cedrane-8,9-Diol as a Key Intermediate for an Amber Odorant.” Organic Process Research and Development 25, no. 1 (2020): 89–97. https://doi.org/10.1021/acs.oprd.0c00423.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 37948
Liu, Xin, and Thomas Werner. “Selective Construction of C−C and C=C Bonds by Manganese Catalyzed Coupling of Alcohols with Phosphorus Ylides.” Advanced Synthesis and Catalysis 363, no. 4 (2020): 1096–1104. https://doi.org/10.1002/adsc.202001209.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 37950
Hu, Yuya, Zhihong Wei, Anna Frey, Christoph Kubis, Chang‐Yue Ren, Anke Spannenberg, Haijun Jiao, and Thomas Werner. “Catalytic, Kinetic, and Mechanistic Insights into the Fixation of CO2 with Epoxides Catalyzed by Phenol‐Functionalized Phosphonium Salts.” ChemSusChem 14, no. 1 (2020): 363–72. https://doi.org/10.1002/cssc.202002267.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 35868
Zhang, Bingru, Kevin Martens, Luisa Kneer, Timon Funck, Linh Nguyen, Ricarda Berger, Mihir Dass, et al. “DNA Origami Nano-Sheets and Nano-Rods Alter the Orientational Order in a Lyotropic Chromonic Liquid Crystal.” Nanomaterials 10, no. 9 (2020). https://doi.org/10.3390/nano10091695.
LibreCat
| DOI
2020 | Dissertation | LibreCat-ID: 41005
Vukadinovic, Yannik. N-Heterocyclic Carbene Based Iron and Ruthenium Photosensitizer with Amine Donors - A Systematic Study on Spectroscopic Differences, 2020. https://doi.org/10.17619/UNIPB/1-1060.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41018
Dierks, Philipp, Ayla Päpcke, Olga S. Bokareva, Björn Altenburger, Thomas Reuter, Katja Heinze, Oliver Kühn, Stefan Lochbrunner, and Matthias Bauer. “Ground- and Excited-State Properties of Iron(II) Complexes Linked to Organic Chromophores.” Inorganic Chemistry 59, no. 20 (2020): 14746–61. https://doi.org/10.1021/acs.inorgchem.0c02039.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41023
Görlin, Mikaela, Joakim Halldin Stenlid, Sergey Koroidov, Hsin-Yi Wang, Mia Börner, Mikhail Shipilin, Aleksandr Kalinko, et al. “Key Activity Descriptors of Nickel-Iron Oxygen Evolution Electrocatalysts in the Presence of Alkali Metal Cations.” Nature Communications 11, no. 1 (2020). https://doi.org/10.1038/s41467-020-19729-2.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41025
Prinz, Nils, Leif Schwensow, Sven Strübbe, Andreas Jentys, Matthias Bauer, Wolfgang Kleist, and Mirijam Zobel. “Hard X-Ray-Based Techniques for Structural Investigations of CO2 Methanation Catalysts Prepared by MOF Decomposition.” Nanoscale 12, no. 29 (2020): 15800–813. https://doi.org/10.1039/d0nr01750g.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41024
Gujt, Jure, Peter Zimmer, Frederik Zysk, Vicky Süß, Claudia Felser, Matthias Bauer, and Thomas Kühne. “Water Structure near the Surface of Weyl Semimetals as Catalysts in Photocatalytic Proton Reduction.” Structural Dynamics 7, no. 3 (2020). https://doi.org/10.1063/4.0000008.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41027
Nowroozi, Mohammad Ali, Kerstin Wissel, Manuel Donzelli, Niloofar Hosseinpourkahvaz, Sergi Plana-Ruiz, Ute Kolb, Roland Schoch, et al. “High Cycle Life All-Solid-State Fluoride Ion Battery with La<jats:Sub>2</Jats:Sub>NiO<jats:Sub>4+d</Jats:Sub> High Voltage Cathode.” Communications Materials 1, no. 1 (2020). https://doi.org/10.1038/s43246-020-0030-5.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41019
Zobel, J. Patrick, Olga S. Bokareva, Peter Zimmer, Christoph Wölper, Matthias Bauer, and Leticia González. “Intersystem Crossing and Triplet Dynamics in an Iron(II) N-Heterocyclic Carbene Photosensitizer.” Inorganic Chemistry 59, no. 20 (2020): 14666–78. https://doi.org/10.1021/acs.inorgchem.0c02147.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41029
Naumova, Maria A., Aleksandr Kalinko, Joanne W. L. Wong, Mohamed Abdellah, Huifang Geng, Edoardo Domenichini, Jie Meng, et al. “Revealing Hot and Long-Lived Metastable Spin States in the Photoinduced Switching of Solvated Metallogrid Complexes with Femtosecond Optical and X-Ray Spectroscopies.” The Journal of Physical Chemistry Letters 11, no. 6 (2020): 2133–41. https://doi.org/10.1021/acs.jpclett.9b03883.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41028
Naumova, Maria A., Aleksandr Kalinko, Joanne W. L. Wong, Sol Alvarez Gutierrez, Jie Meng, Mingli Liang, Mohamed Abdellah, et al. “Exploring the Light-Induced Dynamics in Solvated Metallogrid Complexes with Femtosecond Pulses across the Electromagnetic Spectrum.” The Journal of Chemical Physics 152, no. 21 (2020). https://doi.org/10.1063/1.5138641.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 25302
Ressel, Joerg, Oliver Seewald, Wolfgang Bremser, Hans-Peter Reicher, and Oliver I. Strube. “Self-Lubricating Coatings via PDMS Micro-Gel Dispersions.” Progress in Organic Coatings, 2020. https://doi.org/10.1016/j.porgcoat.2020.105705.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41819
Carl, Nico, Sylvain Prévost, Ralf Schweins, and Klaus Huber. “Contrast Variation of Micelles Composed of Ca2+ and Block Copolymers of Two Negatively Charged Polyelectrolytes.” Colloid and Polymer Science 298, no. 7 (2020): 663–79. https://doi.org/10.1007/s00396-019-04596-1.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41821
Sistemich, Linda, Miriam Kutsch, Benjamin Hämisch, Ping Zhang, Sergii Shydlovskyi, Nathalie Britzen-Laurent, Michael Stürzl, Klaus Huber, and Christian Herrmann. “The Molecular Mechanism of Polymer Formation of Farnesylated Human Guanylate-Binding Protein 1.” Journal of Molecular Biology 432, no. 7 (2020): 2164–85. https://doi.org/10.1016/j.jmb.2020.02.009.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41820
Hämisch, Benjamin, Roland Pollak, Simon Ebbinghaus, and Klaus Huber. “Self‐Assembly of Pseudo‐Isocyanine Chloride as a Sensor for Macromolecular Crowding In Vitro and In Vivo.” Chemistry – A European Journal 26, no. 31 (2020): 7041–50. https://doi.org/10.1002/chem.202000113.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41824
Hämisch, Benjamin, Roland Pollak, Simon Ebbinghaus, and Klaus Huber. “Self‐Assembly of Pseudo‐Isocyanine Chloride as a Sensor for Macromolecular Crowding In Vitro and In Vivo.” Chemistry – A European Journal 26, no. 31 (2020): 7041–50. https://doi.org/10.1002/chem.202000113.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 25901 |
Wortmann, Martin, Natalie Frese, Al Mamun, Marah Trabelsi, Waldemar Keil, Björn Büker, Ali Javed, et al. “Chemical and Morphological Transition of Poly(Acrylonitrile)/Poly(Vinylidene Fluoride) Blend Nanofibers during Oxidative Stabilization and Incipient Carbonization.” Nanomaterials, 2020. https://doi.org/10.3390/nano10061210.
LibreCat
| DOI
| Download (ext.)
2020 | Journal Article | LibreCat-ID: 25899 |
Javed, Ali, Ina Strauss, Hana Bunzen, Jürgen Caro, and Michael Tiemann. “Humidity-Mediated Anisotropic Proton Conductivity through the 1D Channels of Co-MOF-74.” Nanomaterials, 2020. https://doi.org/10.3390/nano10071263.
LibreCat
| DOI
| Download (ext.)
2020 | Journal Article | LibreCat-ID: 25903
Ivanova, Alesja, Bruno Frka-Petesic, Andrej Paul, Thorsten Wagner, Askhat N. Jumabekov, Yury Vilk, Johannes Weber, et al. “Cellulose Nanocrystal-Templated Tin Dioxide Thin Films for Gas Sensing.” ACS Applied Materials & Interfaces, 2020, 12639–47. https://doi.org/10.1021/acsami.9b11891.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 23854 |
Chen, Zimei, Dirk Kuckling, and Michael Tiemann. “Nanoporous Aluminum Oxide Micropatterns Prepared by Hydrogel Templating.” Nanotechnology 31 (2020). https://doi.org/10.1088/1361-6528/aba710.
LibreCat
| DOI
| Download (ext.)
2020 | Journal Article | LibreCat-ID: 25898 |
Zhang, Xuyang, Christian Weinberger, Sabrina Amrehn, Xia Wu, Michael Tiemann, and Thorsten Wagner. “Synthesis of Metal Oxide Inverse Opals from Metal Nitrates by PMMA Colloidal Crystal Templating.” European Journal of Inorganic Chemistry, 2020, 3402–7. https://doi.org/10.1002/ejic.202000517.
LibreCat
| DOI
| Download (ext.)
2020 | Journal Article | LibreCat-ID: 25900 |
Javed, Ali, Thorsten Wagner, Stephan Wöhlbrandt, Norbert Stock, and Michael Tiemann. “Proton Conduction in a Single Crystal of a Phosphonato‐Sulfonate‐Based Coordination Polymer: Mechanistic Insight.” ChemPhysChem, 2020, 605–9. https://doi.org/10.1002/cphc.202000102.
LibreCat
| DOI
| Download (ext.)
2020 | Journal Article | LibreCat-ID: 25902 |
Weinberger, Christian, and Michael Tiemann. “Functional Nanoporous Materials.” Nanomaterials, 2020. https://doi.org/10.3390/nano10040699.
LibreCat
| DOI
| Download (ext.)
2020 | Journal Article | LibreCat-ID: 43747 |
Meier, Torsten, Xuekai Ma, Bernd Berger, Marc Aßmann, Rodislav Driben, Christian Schneider, Sven Höfling, and Stefan Schumacher. “Realization of All-Optical Vortex Switching in Exciton-Polariton Condensates.” Nature Communications 11, no. 1 (2020): 897. https://doi.org/10.1038/s41467-020-14702-5.
LibreCat
| DOI
| Download (ext.)
2020 | Conference Paper | LibreCat-ID: 42892
Wübbeke, Andrea, Volker Schöppner, André Paul, Michael Tiemann, Laura Austermeier, Marcus Fitze, Mingie Chen, et al. “Long- and Short-Term Tensile Strength and Morphology of Joined Beta-Nucleated Polypropylene Parts.” In SPE ANTEC 2020: The Virtual Edition 5 , 2020.
LibreCat
2020 | Journal Article | LibreCat-ID: 24236
Schöppner, Volker, Andrea Wübbeke, Fabian Schriegel, Andrej Paul, Michael Tiemann, Bastian Geißler, Michael Schmidt, Arnaud Magnier, and Thomas Niendorf. “Selected Aspects for the Assessment of Laser Transmission Welding.” Joining Plastics, 2020, 30–35.
LibreCat
2020 | Journal Article | LibreCat-ID: 44995
Dreßler, C., G. Kabbe, Martin Brehm, and D. Sebastiani. “Exploring Non-Equilibrium Molecular Dynamics of Mobile Protons in the Solid Acid CsH2PO4 on the Micrometer and Microsecond Scale.” J. Chem. Phys. 152 (16) (2020): 164110. https://doi.org/10.1063/5.0002167.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 44997
Brehm, Martin, J. Radicke, M. Pulst, F. Shaabani, D. Sebastiani, and J. Kressler. “Dissolving Cellulose in 1,2,3-Triazolium- and Imidazolium-Based Ionic Liquids with Aromatic Anions.” Molecules 25 (15) (2020): 3539. https://doi.org/10.3390/molecules25153539.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 44998
Hunold, J., J. Eisermann, Martin Brehm, and D. Hinderberger. “Characterization of Aqueous Lower Polarity Solvation Shells Around Amphiphilic TEMPO Radicals in Water.” J. Phys. Chem. B 124 (39) (2020): 8601–9. https://doi.org/10.1021/acs.jpcb.0c04863.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 44993
Scarbath-Evers, L., R. Hammer, D. Golze, Martin Brehm, D. Sebastiani, and W. Widdra. “From Flat to Tilted: Gradual Interfaces in Organic Thin Film Growth.” Nanoscale 12 (2020): 3834–45. https://doi.org/10.1039/C9NR06592J.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 44994
Dreßler, C., G. Kabbe, Martin Brehm, and D. Sebastiani. “Dynamical Matrix Propagator Scheme for Large-Scale Proton Dynamics Simulations.” J. Chem. Phys. 152 (11) (2020): 114114. https://doi.org/10.1063/1.5140635.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 44999
Weiß, M., and Martin Brehm. “Exploring Free Energy Profiles of Enantioselective Organocatalytic Aldol Reactions under Full Solvent Influence.” Molecules 25 (24) (2020): 5861. https://doi.org/10.3390/molecules25245861.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 44996
Brehm, Martin, M. Thomas, S. Gehrke, and B. Kirchner. “TRAVIS – A Free Analyzer for Trajectories from Molecular Simulation.” J. Chem. Phys. 152 (16) (2020): 164105. https://doi.org/10.1063/5.0005078.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 24100
Engelkemeier, Katja, Jörg Lindner, Julius Bürger, Kathrin Vaupel, Marc Hartmann, Michael Tiemann, Kay-Peter Hoyer, and Mirko Schaper. “Nano-Architectural Complexity of Zinc Oxide Nanowall Hollow Microspheres and Their Structural Properties.” Nanotechnology 31 (2020): 095701. https://doi.org/10.1088/1361-6528/ab55bc.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 16277 |
Kühne, Thomas, Marcella Iannuzzi, Mauro Del Ben, Vladimir V. Rybkin, Patrick Seewald, Frederick Stein, Teodoro Laino, et al. “CP2K: An Electronic Structure and Molecular Dynamics Software Package - Quickstep: Efficient and Accurate Electronic Structure Calculations.” The Journal of Chemical Physics 152, no. 19 (2020). https://doi.org/10.1063/5.0007045.
LibreCat
| Files available
| DOI
| Download (ext.)
| arXiv
2020 | Conference Paper | LibreCat-ID: 16898
Lass, Michael, Robert Schade, Thomas Kühne, and Christian Plessl. “A Submatrix-Based Method for Approximate Matrix Function Evaluation in the Quantum Chemistry Code CP2K.” In Proc. International Conference for High Performance Computing, Networking, Storage and Analysis (SC), 1127–40. Los Alamitos, CA, USA: IEEE Computer Society, 2020. https://doi.org/10.1109/SC41405.2020.00084.
LibreCat
| DOI
| Download (ext.)
| arXiv
2020 | Preprint | LibreCat-ID: 40994
Bauer, Matthias, Jakob Steube, Ayla Päpcke, Olga Bokareva, Thomas Reuter, Serhiy Demeshko, Roland Schoch, et al. “Janus-Type Dual Emission of a Cyclometalated Iron(III) Complex.” Research Square Platform LLC, 2020.
LibreCat
2020 | Journal Article | LibreCat-ID: 12878 |
Rengaraj, Varadarajan, Michael Lass, Christian Plessl, and Thomas Kühne. “Accurate Sampling with Noisy Forces from Approximate Computing.” Computation 8, no. 2 (2020). https://doi.org/10.3390/computation8020039.
LibreCat
| DOI
| Download (ext.)
| arXiv
2020 | Journal Article | LibreCat-ID: 41022
Kirchhof, Manuel, Katrin Gugeler, Felix Richard Fischer, Michał Nowakowski, Alina Bauer, Sonia Alvarez-Barcia, Karina Abitaev, et al. “Experimental and Theoretical Study on the Role of Monomeric vs Dimeric Rhodium Oxazolidinone Norbornadiene Complexes in Catalytic Asymmetric 1,2- and 1,4-Additions.” Organometallics 39, no. 17 (2020): 3131–45. https://doi.org/10.1021/acs.organomet.0c00310.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41015
Benedikter, Mathis, Janis Musso, Manoj K. Kesharwani, K. Leonard Sterz, Iris Elser, Felix Ziegler, Felix Fischer, et al. “Charge Distribution in Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes: A Combined X-Ray, XAS, XES, DFT, Mössbauer, and Catalysis Approach.” ACS Catalysis 10, no. 24 (2020): 14810–23. https://doi.org/10.1021/acscatal.0c03978.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 41020
Gregori, Bernhard J., Michał Nowakowski, Anke Schoch, Simon Pöllath, Josef Zweck, Matthias Bauer, and Axel Jacobi von Wangelin. “Stereoselective Chromium‐Catalyzed Semi‐Hydrogenation of Alkynes.” ChemCatChem 12, no. 21 (2020): 5359–63. https://doi.org/10.1002/cctc.202000994.
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 16311
Burkhardt, Lukas, Yannik Vukadinovic, Michał Nowakowski, Aleksandr Kalinko, Julian Rudolph, Per-Anders Carlsson, Christoph R. Jacob, and Matthias Bauer. “Electronic Structure of the Hieber Anion [Fe(CO)3(NO)]− Revisited by X-Ray Emission and Absorption Spectroscopy.” Inorganic Chemistry, 2020, 3551–61. https://doi.org/10.1021/acs.inorgchem.9b02092.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 25303
Xue, Hongyao, Haiqin Zhang, Sebastian Fricke, Marco Lüther, Zijiang Yang, Alan Meng, Wolfgang Bremser, and Zhenjiang Li. “Scalable and Energy-Efficient Synthesis of CoxP for Overall Water Splitting in Alkaline Media by High Energy Ball Milling.” Sustainable Energy & Fuels, 2019, 1723–29. https://doi.org/10.1039/c9se00607a.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 21364
Grauke, Reni, Rahel Schepper, Jabor Rabeah, Roland Schoch, Ursula Bentrup, Matthias Bauer, and Angelika Brückner. “Impact of Al Activators on Structure and Catalytic Performance of Cr Catalysts in Homogeneous Ethylene Oligomerization – A Multitechnique in Situ/Operando Study.” ChemCatChem, 2019, 1025–35. https://doi.org/10.1002/cctc.201901441.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 23619
Beal, Rachel E., Nanna Zhou Hagström, Julien Barrier, Aryeh Gold-Parker, Rohit Prasanna, Kevin A. Bush, Donata Passarello, et al. “Structural Origins of Light-Induced Phase Segregation in Organic-Inorganic Halide Perovskite Photovoltaic Materials.” Matter 2 (2019): 207–19. https://doi.org/10.1016/j.matt.2019.11.001.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 23620
Cao, Chuntian, Badri Shyam, Jiajun Wang, Michael F. Toney, and Hans-Georg Steinrück. “Shedding X-Ray Light on the Interfacial Electrochemistry of Silicon Anodes for Li-Ion Batteries.” Accounts of Chemical Research 52 (2019): 2673–83. https://doi.org/10.1021/acs.accounts.9b00233.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 23621
Huang, Tzu-Yen, Felipe A. Larrain, Carlos H. Borca, Canek Fuentes-Hernandez, Hongping Yan, Sebastian Alexander Schneider, Wen-Fang Chou, et al. “Morphology of Organic Semiconductors Electrically Doped from Solution Using Phosphomolybdic Acid.” Chemistry of Materials 31 (2019): 6677–83. https://doi.org/10.1021/acs.chemmater.9b01069.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 23622
Cao, Chuntian, Iwnetim Iwnetu Abate, Eric Sivonxay, Badri Shyam, Chunjing Jia, Brian Moritz, Thomas P. Devereaux, Kristin A. Persson, Hans-Georg Steinrück, and Michael F. Toney. “Solid Electrolyte Interphase on Native Oxide-Terminated Silicon Anodes for Li-Ion Batteries.” Joule 3 (2019): 762–81. https://doi.org/10.1016/j.joule.2018.12.013.
LibreCat
| DOI
2019 | Conference Paper | LibreCat-ID: 23762
Schmitz, Lisa, and Sabine Fechner. “Generierung von Schülerfragen in lebenweltlichen Kontexten.” In Naturwissenschaftliche Bildung als Grundlage für berufliche und gesellschaftliche Teilhabe, edited by Christian Maurer, 225–28. Universität Regensburg: Gesellschaft für Didaktik der Chemie und Physik, Jahrestagung Kiel 2018, 2019.
LibreCat
| Download (ext.)
2019 | Conference Paper | LibreCat-ID: 23763
Akman, Perihan, and Sabine Fechner. “Die Wahrnehmung des Abstraktionsgrades von multiplen Repräsentationen.” In Naturwissenschaftliche Bildung als Grundlage für berufliche und gesellschaftliche Teilhabe. Gesellschaft für Didaktik der Chemie und Physik, Jahrestagung in Kiel 2018, edited by Christian Maurer, 811–14. Universität Regensburg, 2019.
LibreCat
| Download (ext.)
2019 | Conference Paper | LibreCat-ID: 23764
Kehne, Franziska, and Sabine Fechner. “Enkodierung chemischer Konzepte aus lebenweltlichen Kontexten.” In Naturwissenschaftliche Bildung als Grundlage für berufliche und gesellschaftliche Teilhabe. Gesellschaft für Didaktik der Chemie und Physik, Jahrestagung in Kiel 2018, edited by Christian Maurer, 755–58. Universität Regensburg, 2019.
LibreCat
| Download (ext.)
2019 | Journal Article | LibreCat-ID: 22652
Hämisch, Benjamin, Anne Büngeler, Charlotte Kielar, Adrian Keller, Oliver Strube, and Klaus Huber. “Self-Assembly of Fibrinogen in Aqueous, Thrombin-Free Solutions of Variable Ionic Strengths.” Langmuir 35 (2019): 12113–22. https://doi.org/10.1021/acs.langmuir.9b01515.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 22653
Ramakrishnan, Saminathan, Leonard Schärfen, Kristin Hunold, Sebastian Fricke, Guido Grundmeier, Michael Schlierf, Adrian Keller, and Georg Krainer. “Enhancing the Stability of DNA Origami Nanostructures: Staple Strand Redesign versus Enzymatic Ligation.” Nanoscale 11 (2019): 16270–76. https://doi.org/10.1039/c9nr04460d.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 22654
Kielar, Charlotte, Yang Xin, Xiaodan Xu, Siqi Zhu, Nelli Gorin, Guido Grundmeier, Christin Möser, David M. Smith, and Adrian Keller. “Effect of Staple Age on DNA Origami Nanostructure Assembly and Stability.” Molecules 24 (2019): 2577. https://doi.org/10.3390/molecules24142577.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 22655
Ramakrishnan, S, B Shen, MA Kostiainen, Guido Grundmeier, Adrian Keller, and V Linko. “Real-Time Observation of Superstructure-Dependent DNA Origami Digestion by DNase I Using High-Speed Atomic Force Microscopy.” ChemBioChem 20, no. 22 (2019): 2818–23. https://doi.org/10.1002/cbic.201900369.
LibreCat
| DOI
| PubMed | Europe PMC
2019 | Journal Article | LibreCat-ID: 22656
Julin, S, A Korpi, B Shen, V Liljeström, O Ikkala, Adrian Keller, V Linko, and MA Kostiainen. “DNA Origami Directed 3D Nanoparticle Superlattice via Electrostatic Assembly.” Nanoscale 11, no. 10 (2019): 4546–51. https://doi.org/10.1039/c8nr09844a.
LibreCat
| DOI
| PubMed | Europe PMC
2019 | Journal Article | LibreCat-ID: 22657
Hajiraissi, Roozbeh, Marcel Hanke, Alejandro Gonzalez Orive, Belma Duderija, Ulrike Hofmann, Yixin Zhang, Guido Grundmeier, and Adrian Keller. “Effect of Terminal Modifications on the Adsorption and Assembly of HIAPP(20–29).” ACS Omega 4 (2019): 2649–60. https://doi.org/10.1021/acsomega.8b03028.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 22687
Meinderink, Dennis, Karlo J.R. Nolkemper, Julius Bürger, Alejandro G. Orive, Jörg K.N. Lindner, and Guido Grundmeier. “Spray Coating of Poly(Acrylic Acid)/ZnO Tetrapod Adhesion Promoting Nanocomposite Films for Polymer Laminates.” Surface and Coatings Technology, 2019, 112–22. https://doi.org/10.1016/j.surfcoat.2019.06.083.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 15738
Ohto, Tatsuhiko, Mayank Dodia, Jianhang Xu, Sho Imoto, Fujie Tang, Frederik Zysk, Thomas D. Kühne, et al. “Accessing the Accuracy of Density Functional Theory through Structure and Dynamics of the Water–Air Interface.” The Journal of Physical Chemistry Letters 10 (2019): 4914–19. https://doi.org/10.1021/acs.jpclett.9b01983.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 15739
Azadi, Sam, and Thomas D. Kühne. “Unconventional Phase III of High-Pressure Solid Hydrogen.” Physical Review B 100 (2019): 155103–5. https://doi.org/10.1103/physrevb.100.155103.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 15740
Guc, Maxim, Tim Kodalle, Ramya Kormath Madam Raghupathy, Hossein Mirhosseini, Thomas D. Kühne, Ignacio Becerril-Romero, Alejandro Pérez-Rodríguez, Christian A. Kaufmann, and Victor Izquierdo-Roca. “Vibrational Properties of RbInSe2: Raman Scattering Spectroscopy and First-Principle Calculations.” The Journal of Physical Chemistry C 124 (2019): 1285–91. https://doi.org/10.1021/acs.jpcc.9b08781.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 16314
Preiß, Sebastian, Ayla Päpcke, Lukas Burkhardt, Luca Großmann, Stefan Lochbrunner, Matthias Bauer, Till Opatz, and Katja Heinze. “Gold(II) Porphyrins in Photoinduced Electron Transfer Reactions.” Chemistry – A European Journal, 2019, 5940–49. https://doi.org/10.1002/chem.201900050.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 16320
Müller, Patrick, Adam Neuba, Ulrich Flörke, Gerald Henkel, Thomas D. Kühne, and Matthias Bauer. “Experimental and Theoretical High Energy Resolution Hard X-Ray Absorption and Emission Spectroscopy on Biomimetic Cu2S2 Complexes.” The Journal of Physical Chemistry A, 2019, 3575–81. https://doi.org/10.1021/acs.jpca.9b00463.
LibreCat
| DOI
2019 | Dissertation | LibreCat-ID: 16325
Burkhardt, Lukas. Probing Iron-Ligand Interactions by Combining Modern High-Resolution Hard X-Ray Spectroscopy and Density Functional Theory : A Powerful Methodology in Cases Where Conventional Methods Fail / Vorgelegt von Lukas Burkhardt ; [Prof. Dr. Matthias Bauer (Erstgutachter), Prof. Dr. Thomas Kühne (Zweitgutachter), Jun. Prof. Dr. Stephan Hohloch (Drittprüfer)]. Paderborn, 2019. https://doi.org/10.17619/UNIPB/1-745.
LibreCat
| DOI
| Download (ext.)
2019 | Dissertation | LibreCat-ID: 16327
Müller, Patrick. Experimental and Theoretical (High Energy Resolution) X-Ray Absorption and Emission Spectroscopy / Vorgelegt von Patrick Müller ; [Promotionskommission: Prof. Dr.-Ing. Hans-Joachim Warnecke, Vorsitz; Prof. Dr. Matthias Bauer, Erstgutachter; Prof. Dr. Thomas D. Kühne, Zweitgutachter; Prof. Dr. Wolf Gero Schmidt]. Paderborn, 2019. https://doi.org/10.17619/UNIPB/1-705.
LibreCat
| DOI
| Download (ext.)
2019 | Journal Article | LibreCat-ID: 13211
Kodalle, Tim, Ramya Kormath Madam Raghupathy, Tobias Bertram, Natalia Maticiuc, Hasan A Yetkin, René Gunder, Rutger Schlatmann, Thomas D Kühne, Christian A Kaufmann, and Hossein Mirhosseini. “Properties of Co-Evaporated RbInSe2 Thin Films.” Physica Status Solidi (RRL)--Rapid Research Letters 13, no. 3 (2019): 1800564. https://doi.org/10.1002/pssr.201800564.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 13225
Clark, Timothy, Julian Joachim Heske, and Thomas Kühne. “Opposing Electronic and Nuclear Quantum Effects on Hydrogen Bonds in H2O and D2O.” ChemPhysChem 20, no. 0 (2019): 1–6. https://doi.org/10.1002/cphc.201900839.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 13232
Kaliannan, Naveen Kumar , Andres Henao Aristizabal, Hendrik Wiebeler, Frederik Zysk, Tatsuhiko Ohto, Yuki Nagata, and Thomas D. Kühne. “Impact of Intermolecular Vibrational Coupling Effects on the Sum-Frequency Generation Spectra of the Water/Air Interface.” Molecular Physics 0, no. 0 (2019): 1–10. https://doi.org/10.1080/00268976.2019.1620358.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 13233
Müller, Patrick, Adam Neuba, Ulrich Flörke, Gerald Henkel, Thomas D. Kühne, and Matthias Bauer. “Experimental and Theoretical High Energy Resolution Hard X-Ray Absorption and Emission Spectroscopy on Biomimetic Cu2S2 Complexes.” The Journal of Physical Chemistry A 123, no. 16 (2019): 3575–81. https://doi.org/10.1021/acs.jpca.9b00463.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 13236
Walczak, Ralf, Aleksandr Savateev, Julian Joachim Heske, Nadezda V. Tarakina, Sudhir Sahoo, Jan D. Epping, Thomas Kühne, Bogdan Kurpil, Markus Antonietti, and Martin Oschatz. “Controlling the Strength of Interaction between Carbon Dioxide and Nitrogen-Rich Carbon Materials by Molecular Design.” Sustainable Energy Fuels, 2019. https://doi.org/10.1039/C9SE00486F.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 13237
Elgabarty, Hossam, Naveen Kumar Kaliannan, and Thomas D. Kühne. “Enhancement of the Asymmetry in the Hydrogen Bond Network of Liquid Water by an Ultrafast Electric Field Pulse.” Scientific Reports 9 (2019): 10002. https://doi.org/10.1038/s41598-019-46449-5.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 30932
Herberg, Artjom, Xiaoqian Yu, and Dirk Kuckling. “End Group Stability of Atom Transfer Radical Polymerization (ATRP)-Synthesized Poly(N-Isopropylacrylamide): Perspectives for Diblock Copolymer Synthesis.” Polymers 11, no. 4 (2019). https://doi.org/10.3390/polym11040678.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 30929
Li, Jie, Chendong Ji, Xiaoqian Yu, Meizhen Yin, and Dirk Kuckling. “Dually Cross‐Linked Supramolecular Hydrogel as Surface Plasmon Resonance Sensor for Small Molecule Detection.” Macromolecular Rapid Communications 40, no. 14 (2019). https://doi.org/10.1002/marc.201900189.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 30927
Reis, Berthold, David Vehlow, Tarik Rust, Dirk Kuckling, and Martin Müller. “Thermoresponsive Catechol Based-Polyelectrolyte Complex Coatings for Controlled Release of Bortezomib.” International Journal of Molecular Science 20, no. 23 (2019). https://doi.org/10.3390/ijms20236081.
LibreCat
| DOI
2019 | Journal Article | LibreCat-ID: 30928
Yu, Xiaoqian, Artjom Herberg, and Dirk Kuckling. “Azlactone-Functionalized Smart Block Copolymers for Organocatalyst Immobilization.” European Polymer Journal 120 (2019). https://doi.org/10.1016/j.eurpolymj.2019.08.034.
LibreCat
| DOI