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166 Publications
2024 | Journal Article | LibreCat-ID: 51221
Dong, Chuan-Ding, Fabian Bauch, Yuanyuan Hu, and Stefan Schumacher. “Charge Transfer in Superbase N-Type Doping of PCBM Induced by Deprotonation.” Physical Chemistry Chemical Physics 26, no. 5 (2024): 4194–99. https://doi.org/10.1039/d3cp05105f.
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2024 | Journal Article | LibreCat-ID: 52541
Peschtrich, Sebastian, Roland Schoch, Dirk Kuckling, and Jan Paradies. “A Comparative Kinetic and Computational Investigation of the Carbon‐Sulfur Cross Coupling of Potassium Thioacetate and 2‐Bromo Thiophene Using Palladium/Bisphosphine Complexes.” European Journal of Organic Chemistry 27, no. 8 (2024). https://doi.org/10.1002/ejoc.202301207.
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2024 | Journal Article | LibreCat-ID: 52534
Bauch, Fabian, Chuan-Ding Dong, and Stefan Schumacher. “Dynamics of Electron–Hole Coulomb Attractive Energy and Dipole Moment of Hot Excitons in Donor–Acceptor Polymers.” The Journal of Physical Chemistry C 128, no. 8 (2024): 3525–32. https://doi.org/10.1021/acs.jpcc.3c07513.
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2024 | Journal Article | LibreCat-ID: 50726
Schuster, Lilia, Viktoria Olfert, Oleksii Sherepenko, Clemens Fehrenbach, Shiyuan Song, David Hein, Gerson Meschut, Elliot Biro, and Sebastian Münstermann. “Influences of Weld Nugget Shape and Material Gradient on the Shear Strength of Resistance Spot‐Welded Joints.” Steel Research International, 2024. https://doi.org/10.1002/srin.202300530.
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2023 | Journal Article | LibreCat-ID: 43391
Paul, Andreas, Elmar Baumhögger, Mats-Ole Dewerth, Iman Hami Dindar, Gerrit Sonnenrein, and Jadran Vrabec. “Thermal Conductivity of Solid Paraffins and Several N-Docosane Compounds with Graphite.” Journal of Thermal Analysis and Calorimetry, 2023. https://doi.org/10.1007/s10973-023-12107-2.
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2023 | Journal Article | LibreCat-ID: 45828
Duderija, Belma, Alejandro González-Orive, Christoph Ebbert, Vanessa Neßlinger, Adrian Keller, and Guido Grundmeier. “Electrode Potential-Dependent Studies of Protein Adsorption on Ti6Al4V Alloy.” Molecules 28, no. 13 (2023): 5109. https://doi.org/10.3390/molecules28135109.
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2023 | Journal Article | LibreCat-ID: 46480
Müller, Hendrik, Christian Weinberger, Guido Grundmeier, and Maria Teresa de los Arcos de Pedro. “UV-Enhanced Environmental Charge Compensation in near Ambient Pressure XPS.” Journal of Electron Spectroscopy and Related Phenomena 264 (2023). https://doi.org/10.1016/j.elspec.2023.147317.
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2023 | Journal Article | LibreCat-ID: 46542
Huang, Jingyuan, Yunshu Qiu, Felix Lücke, Jiangling Su, Guido Grundmeier, and Adrian Keller. “Multiprotein Adsorption from Human Serum at Gold and Oxidized Iron Surfaces Studied by Atomic Force Microscopy and Polarization-Modulation Infrared Reflection Absorption Spectroscopy.” Molecules 28, no. 16 (2023). https://doi.org/10.3390/molecules28166060.
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2023 | Journal Article | LibreCat-ID: 46543
Pothineni, Bhanu K., Sabrina Kollmann, Xinyang Li, Guido Grundmeier, Denise J. Erb, and Adrian Keller. “Adsorption of Ferritin at Nanofaceted Al2O3 Surfaces.” International Journal of Molecular Sciences 24, no. 16 (2023). https://doi.org/10.3390/ijms241612808.
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2023 | Journal Article | LibreCat-ID: 48167
Strübbe, Sven, Michał Nowakowski, Roland Schoch, and Matthias Bauer. “High‐Resolution X‐ray Absorption and Emission Spectroscopy for Detailed Analysis of New CO2 Methanation Catalysts.” ChemPhysChem, 2023. https://doi.org/10.1002/cphc.202300113.
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2023 | Journal Article | LibreCat-ID: 48639
Kamer, Jerry, Domenik Schleier, Merel Donker, Patrick Hemberger, Andras Bodi, and Jordy Bouwman. “Threshold Photoelectron Spectroscopy and Dissociative Photoionization of Benzonitrile.” Physical Chemistry Chemical Physics 25, no. 42 (2023): 29070–79. https://doi.org/10.1039/d3cp03977c.
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2023 | Journal Article | LibreCat-ID: 49356
Moffitt, Stephanie L., Chuntian Cao, Maikel F. A. M. Van Hest, Laura T. Schelhas, Hans-Georg Steinrück, and Michael F. Toney. “Heterogeneous Structural Evolution of In–Zn–O Thin Films during Annealing.” The Journal of Physical Chemistry C 127, no. 47 (2023): 23099–23108. https://doi.org/10.1021/acs.jpcc.3c06410.
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2023 | Journal Article | LibreCat-ID: 50150
Müller, Patrick, Mergim Meta, Jan Laurenz Meidner, Marvin Schwickert, Jessica Meyr, Kevin Schwickert, Christian Kersten, et al. “Investigation of the Compatibility between Warheads and Peptidomimetic Sequences of Protease Inhibitors—A Comprehensive Reactivity and Selectivity Study.” International Journal of Molecular Sciences 24, no. 8 (2023). https://doi.org/10.3390/ijms24087226.
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2023 | Journal Article | LibreCat-ID: 46023
Duderija, Belma, Alejandro González-Orive, Christoph Ebbert, Vanessa Neßlinger, Adrian Keller, and Guido Grundmeier. “Electrode Potential-Dependent Studies of Protein Adsorption on Ti6Al4V Alloy.” Molecules 28, no. 13 (2023). https://doi.org/10.3390/molecules28135109.
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2023 | Journal Article | LibreCat-ID: 52345
Kitzmann, Winald R., David Hunger, Antti-Pekka M. Reponen, Christoph Förster, Roland Schoch, Matthias Bauer, Sascha Feldmann, Joris van Slageren, and Katja Heinze. “Electronic Structure and Excited-State Dynamics of the NIR-II Emissive Molybdenum(III) Analogue to the Molecular Ruby.” Inorganic Chemistry 62, no. 39 (2023): 15797–808. https://doi.org/10.1021/acs.inorgchem.3c02186.
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2023 | Journal Article | LibreCat-ID: 52344
Ziegler, Felix, Johanna R. Bruckner, Michal Nowakowski, Matthias Bauer, Patrick Probst, Boshra Atwi, and Michael R. Buchmeiser. “Macrocyclization of Dienes under Confinement with Cationic Tungsten Imido/Oxo Alkylidene N‐Heterocyclic Carbene Complexes.” ChemCatChem 15, no. 21 (2023). https://doi.org/10.1002/cctc.202300871.
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2023 | Journal Article | LibreCat-ID: 49608
Fritsch, Lorena, Yannik Vukadinovic, Moritz Lang, Robert Naumann, Maria-Sophie Bertrams, Ayla Kruse, Roland Schoch, et al. “Chemical and Photophysical Properties of Amine Functionalized Bis‐NHC‐pyridine‐RuII Complexes.” ChemPhotoChem, 2023. https://doi.org/10.1002/cptc.202300281.
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2023 | Journal Article | LibreCat-ID: 53078
Apazeller, Sascha, Munko Gonchikzhapov, Monika Nanjaiah, Tina Kasper, Irenäus Wlokas, Hartmut Wiggers, and Christof Schulz. “A New Dual Matrix Burner for One-Dimensional Investigation of Aerosol Flames.” Proceedings of the Combustion Institute 39, no. 1 (2023): 909–18. https://doi.org/10.1016/j.proci.2022.07.166.
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2023 | Journal Article | LibreCat-ID: 36812
Apazeller, Sascha, Munko Gonchikzhapov, Monika Nanjaiah, Tina Kasper, Irenäus Wlokas, Hartmut Wiggers, and Christof Schulz. “A New Dual Matrix Burner for One-Dimensional Investigation of Aerosol Flames.” Proceedings of the Combustion Institute, 2023. https://doi.org/10.1016/j.proci.2022.07.166.
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2022 | Journal Article | LibreCat-ID: 30209
Hanke, Marcel, Niklas Hansen, Ruiping Chen, Guido Grundmeier, Karim Fahmy, and Adrian Keller. “Salting-Out of DNA Origami Nanostructures by Ammonium Sulfate.” International Journal of Molecular Sciences 23, no. 5 (2022): 2817. https://doi.org/10.3390/ijms23052817.
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2022 | Journal Article | LibreCat-ID: 32589
Hanke, Marcel, Niklas Hansen, Emilia Tomm, Guido Grundmeier, and Adrian Keller. “Time-Dependent DNA Origami Denaturation by Guanidinium Chloride, Guanidinium Sulfate, and Guanidinium Thiocyanate.” International Journal of Molecular Sciences 23, no. 15 (2022): 8547. https://doi.org/10.3390/ijms23158547.
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2022 | Journal Article | LibreCat-ID: 33690
Ibaceta-Jaña, Josefa, Manjusha Chugh, Alexander S. Novikov, Hossein Mirhosseini, Thomas Kühne, Bernd Szyszka, Markus R. Wagner, and Ruslan Muydinov. “Do Lead Halide Hybrid Perovskites Have Hydrogen Bonds?” The Journal of Physical Chemistry C 126, no. 38 (2022): 16215–26. https://doi.org/10.1021/acs.jpcc.2c02984.
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2022 | Journal Article | LibreCat-ID: 36810
Knyazkov, Denis A., Andrey V. Cherepanov, Vitaly G. Kiselev, Ilya E. Gerasimov, Tina Kasper, and Andrey G. Shmakov. “Experimental and Kinetic Modeling Study of the Positive Ions in Premixed Ethylene Flames over a Range of Equivalence Ratios.” Proceedings of the Combustion Institute, 2022. https://doi.org/10.1016/j.proci.2022.07.157.
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2022 | Journal Article | LibreCat-ID: 36811
Kaczmarek, Dennis, Charlotte Rudolph, Burak Atakan, and Tina Kasper. “Kinetic Investigation of the Ozone-Assisted Partial Oxidation of Fuel-Rich Natural Gas Mixtures at Elevated Pressure.” Proceedings of the Combustion Institute, 2022. https://doi.org/10.1016/j.proci.2022.07.195.
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2022 | Journal Article | LibreCat-ID: 36813
Bierkandt, Thomas, Patrick Hemberger, Patrick Oßwald, Nina Gaiser, Martin Hoener, Dominik Krüger, Tina Kasper, and Markus Köhler. “A Combustion Chemistry Study of Tetramethylethylene in a Laminar Premixed Low-Pressure Hydrogen Flame.” Proceedings of the Combustion Institute, 2022. https://doi.org/10.1016/j.proci.2022.07.205.
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2022 | Journal Article | LibreCat-ID: 40988
Weber, Sebastian, Ronny T. Zimmermann, Jens Bremer, Ken L. Abel, David Poppitz, Nils Prinz, Jan Ilsemann, et al. “Digitization in Catalysis Research: Towards a Holistic Description of a Ni/Al2O3Reference Catalyst for CO2Methanation.” ChemCatChem 14, no. 8 (2022). https://doi.org/10.1002/cctc.202101878.
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2022 | Journal Article | LibreCat-ID: 41208
Weber, Sebastian, Ronny T. Zimmermann, Jens Bremer, Ken L. Abel, David Poppitz, Nils Prinz, Jan Ilsemann, et al. “Digitization in Catalysis Research: Towards a Holistic Description of a Ni/Al2O3Reference Catalyst for CO2Methanation.” ChemCatChem 14, no. 8 (2022). https://doi.org/10.1002/cctc.202101878.
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2022 | Journal Article | LibreCat-ID: 40425
Bathe, Thomas, Chuan-Ding Dong, and Stefan Schumacher. “Microscopic Study of Molecular Double Doping.” The Journal of Physical Chemistry A 126, no. 13 (2022): 2075–81. https://doi.org/10.1021/acs.jpca.1c09179.
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2022 | Journal Article | LibreCat-ID: 30678
Javed, Muhammad Ali, Sebastian Vater, Elmar Baumhögger, Thorsten Windmann, and Jadran Vrabec. “Apparatus for the Measurement of the Thermodynamic Speed of Sound of Diethylene Glycol and Triethylene Glycol.” The Journal of Chemical Thermodynamics, 2022. https://doi.org/10.1016/j.jct.2022.106766.
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2022 | Journal Article | LibreCat-ID: 33255
Betken, Benjamin, Robin Beckmüller, Muhammad Ali Javed, Elmar Baumhögger, Roland Span, Jadran Vrabec, and Monika Thol. “Thermodynamic Properties for 1-Hexene – Measurements and Modeling.” The Journal of Chemical Thermodynamics, 2022. https://doi.org/10.1016/j.jct.2022.106881.
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2022 | Journal Article | LibreCat-ID: 40987
Schlicher, Steffen, Nils Prinz, Julius Bürger, Andreas Omlor, Christian Singer, Mirijam Zobel, Roland Schoch, et al. “Quality or Quantity? How Structural Parameters Affect Catalytic Activity of Iron Oxides for CO Oxidation.” Catalysts 12, no. 6 (2022). https://doi.org/10.3390/catal12060675.
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2022 | Journal Article | LibreCat-ID: 44231
Schleier, Domenik, Marius Gerlach, Dorothee Schaffner, Deb Pratim Mukhopadhyay, Patrick Hemberger, and Ingo Fischer. “Threshold Photoelectron Spectroscopy of Trimethylborane and Its Pyrolysis Products.” Physical Chemistry Chemical Physics 25, no. 6 (2022): 4511–18. https://doi.org/10.1039/d2cp04513c.
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2021 | Journal Article | LibreCat-ID: 30208
Do, Hoang Tam, Patrick Franke, Sophia Volpert, Marcel Klinksiek, Max Thome, and Christoph Held. “Measurement and Modelling Solubility of Amino Acids and Peptides in Aqueous 2-Propanol Solutions.” Physical Chemistry Chemical Physics 23, no. 18 (2021): 10852–63. https://doi.org/10.1039/d1cp00005e.
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2021 | Journal Article | LibreCat-ID: 31022
Abdelaty, Momen S. A., and Dirk Kuckling. “Altering of Lower Critical Solution Temperature of Environmentally Responsive Poly (N-Isopropylacrylamide-Co-Acrylic Acid-Co-Vanillin Acrylate) Affected by Acrylic Acid, Vanillin Acrylate, and Post-Polymerization Modification.” Colloid and Polymer Science 299, no. 10 (2021): 1617–29. https://doi.org/10.1007/s00396-021-04882-x.
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2021 | Journal Article | LibreCat-ID: 33644
Pylaeva, Svetlana, Patrick Marx, Gurjot Singh, Thomas Kühne, Michael Roemelt, and Hossam Elgabarty. “Organic Mixed-Valence Compounds and the Overhauser Effect in Insulating Solids.” The Journal of Physical Chemistry A 125, no. 3 (2021): 867–74. https://doi.org/10.1021/acs.jpca.0c11296.
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2021 | Journal Article | LibreCat-ID: 33648
Ghasemi, Alireza, and Thomas Kühne. “Artificial Neural Networks for the Kinetic Energy Functional of Non-Interacting Fermions.” The Journal of Chemical Physics 154, no. 7 (2021). https://doi.org/10.1063/5.0037319.
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2021 | Journal Article | LibreCat-ID: 33651
Sahoo, Sudhir K., Ivo F. Teixeira, Aakash Naik, Julian Joachim Heske, Daniel Cruz, Markus Antonietti, Aleksandr Savateev, and Thomas Kühne. “Photocatalytic Water Splitting Reaction Catalyzed by Ion-Exchanged Salts of Potassium Poly(Heptazine Imide) 2D Materials.” The Journal of Physical Chemistry C 125, no. 25 (2021): 13749–58. https://doi.org/10.1021/acs.jpcc.1c03947.
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2021 | Journal Article | LibreCat-ID: 35687
Zhou, Rundong, and Jan Paradies. “Borane Catalyzed Redox Isomerization of 2‐Amino Chalcones: Hydride Abstraction or Hydride Migration?” European Journal of Organic Chemistry 2021, no. 46 (2021): 6334–39. https://doi.org/10.1002/ejoc.202100883.
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2021 | Journal Article | LibreCat-ID: 40433
Dong, Chuan-Ding, and Stefan Schumacher. “Microscopic Insights into Charge Formation and Energetics in N-Doped Organic Semiconductors.” The Journal of Physical Chemistry C 125, no. 40 (2021): 21824–30. https://doi.org/10.1021/acs.jpcc.1c05666.
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2021 | Journal Article | LibreCat-ID: 41324
Maier, Sarah, Steve P. Cronin, Manh-Anh Vu Dinh, Zheng Li, Michael Dyballa, Michal Nowakowski, Matthias Bauer, and Deven P. Estes. “Immobilized Platinum Hydride Species as Catalysts for Olefin Isomerizations and Enyne Cycloisomerizations.” Organometallics 40, no. 11 (2021): 1751–57. https://doi.org/10.1021/acs.organomet.1c00216.
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2021 | Journal Article | LibreCat-ID: 41002
Nguyen, Hoang-Huy, Zheng Li, Toni Enenkel, Joachim Hildebrand, Matthias Bauer, Michael Dyballa, and Deven P. Estes. “Probing the Interactions of Immobilized Ruthenium Dihydride Complexes with Metal Oxide Surfaces by MAS NMR: Effects on CO2 Hydrogenation.” The Journal of Physical Chemistry C 125, no. 27 (2021): 14627–35. https://doi.org/10.1021/acs.jpcc.1c02074.
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2021 | Journal Article | LibreCat-ID: 41012
Winkler, Mario, Marc Schnierle, Felix Ehrlich, Kim-Isabelle Mehnert, David Hunger, Alena M. Sheveleva, Lukas Burkhardt, et al. “Electronic Structure of a Diiron Complex: A Multitechnique Experimental Study of [(Dppf)Fe(CO) 3]+/0.” Inorganic Chemistry 60, no. 5 (2021): 2856–65. https://doi.org/10.1021/acs.inorgchem.0c03259.
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2021 | Journal Article | LibreCat-ID: 41009
Maier, Sarah, Steve P. Cronin, Manh-Anh Vu Dinh, Zheng Li, Michael Dyballa, Michal Nowakowski, Matthias Bauer, and Deven P. Estes. “Immobilized Platinum Hydride Species as Catalysts for Olefin Isomerizations and Enyne Cycloisomerizations.” Organometallics 40, no. 11 (2021): 1751–57. https://doi.org/10.1021/acs.organomet.1c00216.
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2021 | Journal Article | LibreCat-ID: 41326
Wojtaszek, Klaudia, Wojciech Błachucki, Krzysztof Tyrała, Michał Nowakowski, Marcin Zaja̧c, Joanna Stȩpień, Paweł Jagodziński, et al. “Determination of Crystal-Field Splitting Induced by Thermal Oxidation of Titanium.” The Journal of Physical Chemistry A 125, no. 1 (2021): 50–56. https://doi.org/10.1021/acs.jpca.0c07955.
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2021 | Journal Article | LibreCat-ID: 35326
Keil, Waldemar, Kai Zhao, Arthur Oswald, Wolfgang Bremser, Claudia Schmidt, and Horst Hintze-Bruening. “Thermostable Water Reservoirs in the Interlayer Space of a Sodium Hectorite Clay through the Intercalation of γ-Aminopropyl(Dimethyl)Ethoxysilane in Toluene.” Physical Chemistry Chemical Physics 24, no. 1 (2021): 477–87. https://doi.org/10.1039/d1cp03321b.
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2021 | Journal Article | LibreCat-ID: 29748
Slawig, Diana, Markus Gruschwitz, Uwe Gerstmann, Eva Rauls, and Christoph Tegenkamp. “Adsorption and Reaction of PbPc on Hydrogenated Epitaxial Graphene.” The Journal of Physical Chemistry C 125, no. 36 (2021): 20087–93. https://doi.org/10.1021/acs.jpcc.1c06320.
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2021 | Journal Article | LibreCat-ID: 32240
Chatwell, René Spencer, Gabriela Guevara-Carrion, Yuri Gaponenko, Valentina Shevtsova, and Jadran Vrabec. “Diffusion of the Carbon Dioxide–Ethanol Mixture in the Extended Critical Region.” Physical Chemistry Chemical Physics 23, no. 4 (2021): 3106–15. https://doi.org/10.1039/d0cp04985a.
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2020 | Journal Article | LibreCat-ID: 32246
Mirhosseini, Hossein, Ramya Kormath Madam Raghupathy, Sudhir K. Sahoo, Hendrik Wiebeler, Manjusha Chugh, and Thomas D. Kühne. “In Silico Investigation of Cu(In,Ga)Se2-Based Solar Cells.” Physical Chemistry Chemical Physics 22, no. 46 (2020): 26682–701. https://doi.org/10.1039/d0cp04712k.
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2020 | Journal Article | LibreCat-ID: 34301
Elgabarty, Hossam, and Thomas Kühne. “Tumbling with a Limp: Local Asymmetry in Water’s Hydrogen Bond Network and Its Consequences.” Physical Chemistry Chemical Physics 22, no. 19 (2020): 10397–411. https://doi.org/10.1039/c9cp06960g.
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2020 | Journal Article | LibreCat-ID: 32491
Trubachev, S.A., O.P. Korobeinichev, A.I. Karpov, A.A. Shaklein, R.K. Glaznev, M.B. Gonchikzhapov, A.A. Paletsky, et al. “The Effect of Triphenyl Phosphate Inhibition on Flame Propagation over Cast PMMA Slabs.” Proceedings of the Combustion Institute 38, no. 3 (2020): 4635–44. https://doi.org/10.1016/j.proci.2020.05.043.
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