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[Journal Article]
Fast Screening of Minimum Energy Crossing Points with Semiempirical Tight-Binding Methods
In: Journal of chemical theory and computation : JCTC, 18 (10), 6370-6385, 2022
[DOI: 10.1021/acs.jctc.2c00578]Pracht, Philipp
Bannwarth, Christoph Nils (Corresponding author) -
[Journal Article]
Reversible Oxidative Addition of Zinc Hydride at a Gallium(I)-Centre: Labile Mono- and Bis(hydridogallyl)zinc Complexes
In: Chemistry - a European journal, 28 (56), e202201480, 2022
[DOI: 10.1002/chem.202201480]Morris, Louis J.
Rajeshkumar, Thayalan
Maron, Laurent (Corresponding author)
Okuda, Jun (Corresponding author) -
[Journal Article]
The origin of high Na+ ion conductivity in Na1+xZr2SixP3−xO12 NASICON materials
In: Physical chemistry, chemical physics : PCCP, 24 (36), 22154-22167, 2022
[DOI: 10.1039/D2CP03621E]Schütt, Judith
Pescher, Fiona
Neitzel-Grieshammer, Steffen Paul (Corresponding author) -
[Journal Article]
Exploring the Impact of Lone Pairs on the Structural Features of Alkaline-Earth (A) Transition-Metal (M,M’) Chalcogenides (Q) AMM'Q3
In: European journal of inorganic chemistry, 2022 (28), e202200360, 2022
[DOI: 10.1002/ejic.202200360]Eickmeier, Katharina
Poschkamp, Ruben
Dronskowski, Richard
Steinberg, Simon (Corresponding author) -
[Journal Article]
Preparation of Enantiopure 3-Aminopiperidine and 3-Aminoazepane Derivatives from Ornithine and Lysine. Consecutive Syntheses of Pharmacologically Active Analogs, Such as Besifloxacin
In: Organic process research & development, 26 (10), 2811-2822, 2022
[DOI: 10.1021/acs.oprd.2c00152]Schiffers, Ingo
Frings, Marcus
Kübber, Britta Maria
Truong, Khai-Nghi
Rissanen, Kari
et al. -
[Journal Article]
Nickel Catalyzed Regiodivergent Cross-Coupling Alkylation of Aryl Halides with Redox-Active Imines
In: ACS catalysis, 12 (19), 11563-11572, 2022
[DOI: 10.1021/acscatal.2c03396]Huang, Long (Corresponding author)
Kancherla, Rajesh
Rüping, Magnus (Corresponding author) -
[Dissertation / PhD Thesis]
Development of new chemical oxidative, step and atom efficient C-N and N-N bond forming coupling reactions, 2022
[DOI: 10.18154/RWTH-2022-09394]Vemuri, Pooja Yasaswi -
[Journal Article]
Influence of the SEI Formation on the Stability and Lithium Diffusion in Si Electrodes
In: ACS omega, 7 (36), 32740-32748, 2022
[DOI: 10.1021/acsomega.2c04415]Wu, Baolin
Chen, Chunguang (Corresponding author)
Danilov, Dmitri L.
Jiang, Ming
Raijmakers, Luc H. J.
et al. -
[Dissertation / PhD Thesis]
N-sulfenylations of sulfoximines/sulfonimidamides and radical reactions with sulfur-containing compounds in solution and under mechanochemical conditions, 2022
[DOI: 10.18154/RWTH-2022-09309]Kong, Deshen -
[Journal Article]
TUCAN: A molecular identifier and descriptor applicable to the whole periodic table from hydrogen to oganesson
In: Journal of cheminformatics, 14 (1), 66, 2022
[DOI: 10.1186/s13321-022-00640-5]Brammer, Jan C.
Blanke, Gerd
Kellner, Claudia
Hoffmann, Alexander
Herres-Pawlis, Sonja (Corresponding author)
et al. -
[Journal Article]
Forced disorder in the solid solution li3p-li2s: a new class of fully reduced solid electrolytes for lithium metal anodes
In: Journal of the American Chemical Society : JACS, 144 (36), 16350-16365, 2022
[DOI: 10.1021/jacs.2c01913]Szczuka, Conrad
Karasulu, Bora
Groh, Matthias F.
Sayed, Farheen N.
Sherman, Timothy J.
et al. -
[Journal Article]
Copper-Decorated Iron Carbide Nanoparticles Heated by Magnetic Induction as Adaptive Multifunctional Catalysts for the Selective Hydrodeoxygenation of Aldehydes
In: Advanced energy materials, 12 (42), 2201783, 2022
[DOI: 10.1002/aenm.202201783]Lin, Sheng-Hsiang
Hetaba, Walid
Chaudret, Bruno
Leitner, Walter (Corresponding author)
Bordet, Alexis (Corresponding author) -
[Journal Article]
Cellulose-based functional hydrogels derived from bamboo for product design
In: Frontiers in Functional Plant Ecology, 13, 958066, 2022
[DOI: 10.3389/fpls.2022.958066]Cao, Xiaobing (Corresponding author)
Li, Fei
Zheng, Tingting
Li, Guohui
Wang, Wenqian
et al. -
[Contribution to a book, Journal Article]
Heterometallic {Fe 18 M 6 } (M = Y, Gd, Dy) Pivalate Wheels Display Solvent-Induced Polymorphism
In: Crystal growth & design, 22 (9), 5526-5534, 2022
[DOI: 10.1021/acs.cgd.2c00620]Podgornii, Daniel
Amombo Noa, Francoise M.
van Leusen, Jan
McKenzie, Christine J.
Öhrström, Lars (Corresponding author)
et al. -
[Journal Article]
Aqueous microgels with engineered hydrophobic nano-domains
In: Molecular systems design & engineering, 7 (10), 1207-1227, 2022
[DOI: 10.1039/D2ME00125J]Belthle, Thomke
Pich, Andrij (Corresponding author) -
[Journal Article]
A wireless and battery-free DNA hydrogel biosensor for wound infection monitoring
In: Matter, 5 (8), 2473-2475, 2022
[DOI: 10.1016/j.matt.2022.06.021]Li, Xin
Lu, Yi
Hu, Yong (Corresponding author) -
[Journal Article]
Epoxidation of methyl oleate over various amorphous Ti-SiO2 catalysts
In: Reaction kinetics, mechanisms and catalysis, 135 (5), 2591-2609, 2022
[DOI: 10.1007/s11144-022-02289-5]Kim, Kyunghoon
Venschott, Moritz (Corresponding author)
Hölderich, Wolfgang F. -
[Journal Article]
Supercritical carbon dioxide as reaction medium for selective hydrogenation of fluorinated arenes
In: Green chemistry : GC, 24 (22), 8671-8676, 2022
[DOI: 10.1039/D2GC02623F]Kacem, Souha
Qiao, Yunxiang
Dieckmann, Cornelia
Theyssen, Nils
Bordet, Alexis (Corresponding author)
et al. -
[Contribution to a book, Journal Article]
Effects of the Chalcogenide Identity in N-Aryl Phenochalcogenazine Photoredox Catalysts
In: ChemCatChem, 14 (17), e202200485, 2022
[DOI: 10.1002/cctc.202200485]Corbin, Daniel A.
Cremer, Christopher
Puffer, Katherine O.
Newell, Brian S.
Patureau, Frederic W.
et al. -
[Journal Article]
Rhodium-Catalyzed Asymmetric Hydrohydrazonemethylation of Styrenes: Access to Chiral Hydrazones, Hydrazides, Hydrazines and Amines
In: Advanced synthesis & catalysis, 10, adsc.202200804, 2022
[DOI: 10.1002/adsc.202200804]Kliemann, Max N.
Teeuwen, Simon
Weike, Christopher
Franciò, Giancarlo (Corresponding author)
Leitner, Walter -
[Journal Article]
Formate complexes of tri- and tetravalent titanium supported by a tris(phenolato)amine ligand
In: Dalton transactions, 51 (37), 14345-14351, 2022
[DOI: 10.1039/D2DT01739C]Okumura, Akira
Ghana, Priyabrata
Fink, Fabian
Schmidt, Regina
Hoffmann, Alexander
et al. -
[Dissertation / PhD Thesis]
N-Funktionalisierungen an Sulfoximinen : N-Alkinylierte, N-Tetrafluorpyridylierte und N-Schwefel-funktionalisierte Sulfoximine, 2022
[DOI: 10.18154/RWTH-2022-09151]Fergen, Hannah -
[Poster]
A Computational and Experimental Study of Deuteration Effect on Transition Temperature of PNIPAM Microgels
In: 3. International Summer School on Functional Microgels and Microgel Systems, 2022Nevolianis, Thomas
Scotti, Andrea
Petrunin, Alexander
Richtering, Walter
Leonhard, Kai -
[Dissertation / PhD Thesis]
Synthese molekularer Dipole für die organische Elektronik, C-H-Funktionalisierung von Ferrocenen und Kreuzkupplung zur Herstellung von Sulfoximinen, 2022
[DOI: 10.18154/RWTH-2022-09055]Calin, Marc -
[Journal Article]
Lithium phosphosulfide electrolytes for solid-state batteries: Part I
In: Functional materials letters, 15 (5), 2240001, 2022
[DOI: 10.1142/S179360472240001X]Lu, Xin (Corresponding author)
Tsai, Chih-Long
Yu, Shicheng
He, Hongying
Camara, Osmane
et al. -
[Contribution to a book, Journal Article]
Assessing the NLRP3 Inflammasome Activating Potential of a Large Panel of Micro- and Nanoplastics in THP-1 Cells
In: Biomolecules : open access journal, 12 (8), 1095, 2022
[DOI: 10.3390/biom12081095]Busch, Mathias
Bredeck, Gerrit
Waag, Friedrich
Rahimi, Khosrow
Ramachandran, Haribaskar
et al. -
[Journal Article]
Mechanoresponsive diselenide-crosslinked microgels with programmed ultrasound-triggered degradation and radical scavenging ability for protein protection
In: Chemical science, 13 (38), 11304-11311, 2022
[DOI: 10.1039/D2SC03153A]Kharandiuk, Tetiana (Corresponding author)
Tan, Kok Hui
Xu, Wenjing
Weitenhagen, Fabian
Braun, Susanne
et al. -
[Contribution to a book, Journal Article]
Comparison of Industrial and Lab-Scale Ion Exchange for the DeNOx-SCR Performance of Cu Chabazites : A Case Study
In: Catalysts : open access journal, 12 (8), 880, 2022
[DOI: 10.3390/catal12080880]Rizzotto, Valentina
Bajić, Stefan
Formenti, Dario
Wu, Xiaochao (Corresponding author)
Sauerbeck, Silke
et al. -
[Journal Article]
The Preparation of Diaryl Sulfoxinium Triflates and Their Application in Palladium-Catalyzed Cross-Coupling Reactions
In: Chemistry, 17 (19), e202200828, 2022
[DOI: 10.1002/asia.202200828]Wang, Chenyang
Wang, Xianliang
Kong, Deshen
Truong, Khai-Nghi
Rissanen, Kari
et al. -
[Dissertation / PhD Thesis]
Rational design of bimetallic coordination polymers by utilizing heteroditopic ligands : synthesis, structural analysis and thermal decomposition, 2022
[DOI: 10.18154/RWTH-2022-08865]van Terwingen, Steven -
[Journal Article]
A defined heat pretreatment of gelatin enables control of hydrolytic stability, stiffness, and microstructural architecture of fibrin-gelatin hydrogel blends
In: Biomaterials science (10), 5552-5565, 2022
[DOI: 10.1039/D2BM00214K]Wachendörfer, Mattis
Schräder, Philipp
Buhl, Eva Miriam
Palkowitz, Alena L.
Ben Messaoud, Ghazi
et al. -
[Journal Article]
Making more from bio-based platforms: life cycle assessment and techno-economic analysis of N-vinyl-2-pyrrolidone from succinic acid
In: Green chemistry : GC, 24 (17), 6671-6684, 2022
[DOI: 10.1039/d2gc01219g]Haus, Moritz Otto
Winter, Benedikt
Fleitmann, Lorenz Heinrich Johannes
Palkovits, Regina (Corresponding author)
Bardow, André (Corresponding author) -
[Journal Article]
Understanding the structure-activity relationship and performance of highly active novel ATRP catalysts
In: Dalton transactions, 51, 13272-13287, 2022
[DOI: 10.1039/d2dt01954j]Kröckert, Konstantin Wilhelm
Garg, Felix
Heinz, Michel V.
Lange, Justin
Simões, Patricia P.
et al. -
[Journal Article]
Study of base-catalyzed isomerization of d-glucose with a focus on reaction kinetics
In: Reaction kinetics, mechanisms and catalysis, 135 (5), 2357-2377, 2022
[DOI: 10.1007/s11144-022-02277-9]Fischer, Matthias
Drabo, Peter
Delidovich, Irina (Corresponding author) -
[Journal Article]
α-Thianthrenium Carbonyl Species: The Equivalent of an α-Carbonyl Carbocation
In: Angewandte Chemie / International edition, 61 (39), e202208978, 2022
[DOI: 10.1002/anie.202208978]Jia, Hao
Ritter, Tobias (Corresponding author) -
[Journal Article]
Mechanoresponsive Carbamoyloximes for the Activation of Secondary Amines in Polymers
In: Angewandte Chemie / International edition, 61 (39), e202207557, 2022
[DOI: 10.1002/anie.202207557]Campagna, Davide
Göstl, Robert (Corresponding author) -
[Journal Article]
Furan Synthesis via Triplet Sensitization of Acceptor/Acceptor Diazoalkanes
In: Advanced synthesis & catalysis, 364 (18), 3149-3154, 2022
[DOI: 10.1002/adsc.202200654]Zhu, Siqi
Li, Fang
Empel, Claire
Jana, Sripati
Pei, Chao
et al. -
[Journal Article]
Stainless steel-initiated thiosulfonylations of unactivated alkenes under solvent-free conditions in a mixer mill
In: Green chemistry : GC, 24 (17), 6476-6480, 2022
[DOI: 10.1039/D2GC02519A]Kong, Deshen
Bolm, Carsten (Corresponding author) -
[Dissertation / PhD Thesis]
C(sp3)-H functionalization of hydrofluorocarbons (HFCs) and hydrochlorocarbons, 2022
[DOI: 10.18154/RWTH-2022-08675]Xiang, Jiaxiang -
[Journal Article]
Nanoscale visualization of metallic electrodeposition in a well-controlled chemical environment
In: Nanotechnology, 33 (44), 445702, 2022
[DOI: 10.1088/1361-6528/ac83c7]Cheng, Ningyan
Sun, Hongyu
Beker, Anne France
van Omme, J. Tijn
Svensson, Emil
et al. -
[Journal Article]
Phase Transformations and Phase Segregation during Potassiation of Sn$_{x}$P$_{y}$ Anodes
In: Chemistry of materials, 34 (16), 7460-7467, 2022
[DOI: 10.1021/acs.chemmater.2c01570]Ells, Andrew W.
Evans, Matthew L.
Groh, Matthias F.
Morris, Andrew J. (Corresponding author)
Marbella, Lauren E. (Corresponding author) -
[Journal Article]
Formic acid as H 2 storage system: hydrogenation of CO 2 and decomposition of formic acid by solid molecular phosphine catalysts
In: Catalysis science & technology, 12 (18), 5649-5656, 2022
[DOI: 10.1039/D2CY00608A]Kipshagen, Anna
Baums, Janine Christine
Hartmann, Heinrich
Besmehn, Astrid
Hausoul, Peter J. C. (Corresponding author)
et al. -
[Contribution to a book, Journal Article]
Steam Electrolysis vs. Co-Electrolysis: Mechanistic Studies of Long-Term Solid Oxide Electrolysis Cells
In: Energies : open-access journal of related scientific research, technology development and studies in policy and management, 15 (15), 5449, 2022
[DOI: 10.3390/en15155449]Wolf, Stephanie E. (Corresponding author)
Vibhu, Vaibhav (Corresponding author)
Tröster, Eric
Vinke, Izaak C.
Eichel, Rüdiger-A.
et al. -
[Journal Article]
The Orbital Nature of Electron Holes in BaFeO$_{3}$ and Implications for Defect Chemistry
In: The journal of physical chemistry / C, 126 (30), 12809-12819, 2022
[DOI: 10.1021/acs.jpcc.2c02545]Hoedl, M. F. (Corresponding author)
Ertural, Christina
Merkle, R.
Dronskowski, Richard
Maier, J. -
[Journal Article]
Branched Tertiary Amines from Aldehydes and α-Olefins by Combined Multiphase Tandem Reactions
In: Chemistry - a European journal, 28 (58), e202202081, 2022
[DOI: 10.1002/chem.202202081]Strohmann, Marc
Vorholt, Andreas J. (Corresponding author)
Leitner, Walter -
[Journal Article]
Solvent‐Dependent Oxidative Addition and Reductive Elimination of H$_{2}$ Across a Gallium‐Zinc Bond
In: Angewandte Chemie / International edition, 61 (36), e202208855, 2022
[DOI: 10.1002/anie.202208855]Morris, Louis J.
Rajeshkumar, Thayalan
Okumura, Akira
Maron, Laurent (Corresponding author)
Okuda, Jun (Corresponding author) -
[Journal Article]
Homolytic N−S Bond Cleavage in Vinyl Triflimides Enabled by Triplet-Triplet Energy Transfer
In: Chemistry - a European journal, 28 (53), e202201830, 2022
[DOI: 10.1002/chem.202201830]Strauch, Christina
Schroeder, Sebastian
Grelier, Gwendal
Niggemann, Meike (Corresponding author) -
[Journal Article]
Refined high-pressure tube design for improved resolution in high-pressure NMR spectroscopy
In: The analyst : the analytical journal of the Royal Society of Chemistry, 147 (17), 3827-3832, 2022
[DOI: 10.1039/D2AN00926A]Duchowny, Anton
Ortiz Restrepo, Sergio Alejandro
Adams, Michael
Thelen, Ralf
Adams, Alina Reghina (Corresponding author) -
[Journal Article]
Featurizing chemistry for machine learning — methods and a coded example
In: Current opinion in chemical engineering, 37, 100840, 2022
[DOI: 10.1016/j.coche.2022.100840]Gierlich, Christian Henning
Palkovits, Stefan (Corresponding author) -
[Journal Article]
Between Elemental Match and Mismatch: From K$_{12}$Ge$_{3.5}$Sb$_{6}$ to Salts of (Ge$_{2}$Sb$_{2}$)$^{2−}$, (Ge$_{4}$Sb$_{12}$)$^{4−}$, and (Ge$_{4}$Sb$_{14}$)$^{4−}$ : Dedicated to Professor Dieter Fenske on the occasion of his 80th birthday
In: Angewandte Chemie, 134 (41), e202207232, 2022
[DOI: 10.1002/ange.202207232]Beuthert, Katrin
Pan, Fuxing
Guggolz, Lukas
Wilson, Robert J.
Hempelmann, Jan
et al.
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