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Published in 2019 at "Journal of Molecular Modeling"
DOI: 10.1007/s00894-019-4280-4
Abstract: A variety of researches on boron oxide clusters have indicated the key role of boronyl (BO) group in the structures and bonding. Based upon global structural searches and electronic structure calculations at the B3LYP and…
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Keywords:
boron oxide;
doped boron;
crown like;
lithium doped ... See more keywords
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Published in 2022 at "Journal of the American Chemical Society"
DOI: 10.1021/jacs.2c08237
Abstract: Boron oxide/hydroxide supported on oxidized activated carbon (B/OAC) was shown to be an inexpensive catalyst for the oxidative dehydrogenation (ODH) of propane that offers activity and selectivity comparable to boron nitride. Here, we obtain an…
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Keywords:
boron oxide;
spectroscopy;
11b 17o;
atomistic picture ... See more keywords
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Published in 2017 at "Glass Physics and Chemistry"
DOI: 10.1134/s1087659617020055
Abstract: It is shown that the relaxation of the isotropic light scattering intensity by boron oxide melt, which is connected with a decrease in its magnitude after a temperature jump, is synchronized with the effect of…
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Keywords:
boron oxide;
light scattering;
oxide melt;
specifics light ... See more keywords
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Published in 2022 at "Frontiers in Chemistry"
DOI: 10.3389/fchem.2022.868782
Abstract: Boron oxide clusters have structural richness and exotic chemical bonding. We report a quantum chemical study on the binary B5O6 − cluster, which is relatively oxygen-rich. A global structural search reveals planar C 2v (1A1)…
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Keywords:
boronyl;
boron oxide;
analog phenolate;
cluster ... See more keywords