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Published in 2024 at "Advanced Functional Materials"
DOI: 10.1002/adfm.202415610
Abstract: While ∼30% of materials are reported to be topological, topological insulators are rare. Magnetic topological insulators (MTI) are even harder to find. Identifying crystallographic features that can host the coexistence of a topological insulating phase…
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Keywords:
insulator;
bonding interactions;
interactions drive;
topological insulators ... See more keywords
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Published in 2025 at "Advanced Materials"
DOI: 10.1002/adma.202502015
Abstract: Lead‐free tin‐based perovskites, specifically (4‐Cl‐PEA)2SnI4, possess significant potential for the development of high‐performance, robust neuromorphic imaging sensors, owing to their superior optoelectronic properties and compatibility with conventional complementary metal‐oxide‐semiconductor fabrication techniques and silicon‐based readout circuits.…
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Keywords:
neuromorphic imaging;
bonding interactions;
resolution;
lead free ... See more keywords
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Published in 2019 at "Journal of Molecular Liquids"
DOI: 10.1016/j.molliq.2019.02.058
Abstract: Abstract Only a small amount of peptide bonds exists in the cis conformation, however, they play an important role in the functioning of proteins. Herein, 2-pyrrolidinone (C4H7NO) was used as a cis-proline analog to study…
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Keywords:
bonding interactions;
cis proline;
hydrogen;
study hydrogen ... See more keywords
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Published in 2021 at "Journal of Molecular Structure"
DOI: 10.1016/j.molstruc.2020.129063
Abstract: Abstract A new cobalt phosphonate coordination polymer {[Co2(BrBzPO3)2(bpy)]∙2H2O}n (1) has been synthesized from the reactions of Co(NO3)2, 2-bromobenzyl phosphonic acid (BrBzP(O)(OH)2), and 4,4′-bipyridine (bpy) via reactants slow diffusion in H2O/ethanol solvent media at 60°C. Single-crystal…
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Keywords:
network;
phosphonate coordination;
cobalt phosphonate;
halogen bonding ... See more keywords
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Published in 2021 at "Journal of Molecular Structure"
DOI: 10.1016/j.molstruc.2021.130717
Abstract: Abstract Studying the non-covalent interactions is the central core of research for the researchers in supramolecular chemistry. In such a way, a proton transfer molecular salt, N,N-Dimethyl-4-aminopyridinium benzilate (DAPB) has been synthesized and the crystal…
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Keywords:
bonding interactions;
hydrogen;
aminopyridinium benzilate;
dimethyl aminopyridinium ... See more keywords
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Published in 2024 at "Biochemistry"
DOI: 10.1021/acs.biochem.4c00209
Abstract: Hydrogen-bonding (H-bonding) interactions in metalloprotein active sites can critically regulate enzyme function. Changes in the protein structure triggered by interplay with substrates, products, and partner proteins are often translated to the metallocofactor by way of…
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Keywords:
conformation;
bonding interactions;
hydrogen bonding;
switchable artificial ... See more keywords
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Published in 2023 at "Inorganic chemistry"
DOI: 10.1021/acs.inorgchem.2c04538
Abstract: Neptunium makes up the largest percentage of minor actinides found in spent nuclear fuel, yet separations of this element have proven difficult due to its rich redox chemistry. Developing new reprocessing techniques should rely on…
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Keywords:
chemistry;
influencing bonding;
interactions neptunyl;
electron donating ... See more keywords
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Published in 2024 at "Inorganic chemistry"
DOI: 10.1021/acs.inorgchem.4c03906
Abstract: In a recent study (Inorg. Chem. 2024, 63, 11812-11820), gas-phase cationic NiX+ compounds (X = F, Cl, Br, and I) were probed by nickel L-edge XAS, from which it was concluded that NiF+ was best…
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Keywords:
nix compounds;
bonding interactions;
initio;
nature nickel ... See more keywords
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Published in 2018 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.7b01078
Abstract: We present a new analysis of exchange and dispersion effects for calculating halogen-bonding interactions in a wide variety of complex dimers (69 total) within the XB18 and XB51 benchmark sets. Contrary to previous work on…
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Keywords:
exchange dispersion;
bonding interactions;
exchange;
halogen bonding ... See more keywords
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Published in 2017 at "Macromolecules"
DOI: 10.1021/acs.macromol.7b00281
Abstract: A structurally novel iodoperfluoroarene-substituted polystyrene has been synthesized, and its noncovalent halogen bonding interactions with polymeric Lewis bases have been studied. RAFT polymerization was used to generate halogen bond donating polystyrene derivatives with low dispersities.…
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Keywords:
self assembly;
polymer nanostructures;
assembly polymer;
halogen bonding ... See more keywords
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Published in 2018 at "Macromolecules"
DOI: 10.1021/acs.macromol.8b00344
Abstract: The interactions between polymer molecules in solution are strongly affected by the way that the constituent polymers interact with the solvent. In this work, we use a mixed solvent system (dimethyl sulfoxide and ethylene glycol)…
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Keywords:
solvent composition;
hydrogen;
tuning viscoelasticity;
hydrogen bonding ... See more keywords