Results 21 to 30 of about 45,903 (284)
Structure and Stability of Small Boron and Boron Oxide Clusters [PDF]
ChemInform, 2007 AbstractChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 200 leading journals. To access a ChemInform Abstract, please click on HTML or PDF.
Michael L, Drummond +2 more
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Evolving patterns in boron cluster chemistry [PDF]
Pure and Applied Chemistry, 2003 Abstract This paper outlines the development of our knowledge and understanding of the structures and bonding of boron cluster compounds, with particular reference to the evolving complementary roles localized bonding and molecular orbital treatments have played in providing simple rationalizations of their polyhedral molecules.
Fox, M. A., Wade, K.
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Relative Stability of Boron Planar Clusters in Diatomic Molecular Model
Molecules, 2022 In the recently introduced phenomenological diatomic molecular model imagining the clusters as certain constructions of pair interatomic chemical bonds, there are estimated specific (per atom) binding energies of small all-boron planar clusters Bn, n = 1–
Levan Chkhartishvili
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Boron clusters as breast cancer therapeutics
Journal of Inorganic Biochemistry, 2021 Since the foundation of small molecule-based therapeutics over 100 years ago, their design has been dominated by organic based components. This has also been apparent in anti-cancer therapeutics in a broad range of strategies; from the older DNA chelating drugs, to the more recent molecular-targeted therapies.
Neville, Murphy +3 more
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Catalytic role of boron atoms in self-interstitial clustering in Si [PDF]
, 2003 Using density functional theory (DFT) calculations and kinetic simulations, we have investigated the influence of boron atoms on self-interstitial clustering in Si. From DFT calculations of neutral interstitial clusters with a single B atom (BsIn, nIn–1 +
Goddard, William A., III +1 more
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Pharmaceuticals, 2022 In this review, the history of boron’s early use in drugs, and the history of the use of boron functional groups in medicinal chemistry applications are discussed. This includes diazaborines, boronic acids, benzoxaboroles, boron clusters, and carboranes.
Katia Messner +2 more
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Boron-Decorated Pillared Graphene as the Basic Element for Supercapacitors: An Ab Initio Study
Applied Sciences, 2021 In this work, using the first-principle density functional theory (DFT) method, we study the properties of a new material based on pillared graphene and the icosahedral clusters of boron B12 as a supercapacitor electrode material.
Dmitry A. Kolosov, Olga E. Glukhova
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Stability and Electronic Properties of TiO2 Nanostructures With and Without B and N Doping [PDF]
, 2009 We address one of the main challenges to TiO2-photocatalysis, namely band gap narrowing, by combining nanostructural changes with doping. With this aim we compare TiO2's electronic properties for small 0D clusters, 1D nanorods and nanotubes, 2D layers ...
Angelis F. D. +33 more
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Interior Melting of the C3B16 and C2B14− Clusters Between 1000 K and 2000 K
Condensed Matter, 2017 For bulk three-dimensional materials, it is common for the surface to melt at a slightly lower temperature than the bulk. This is known as surface melting, and is typically due to the fact that there are fewer bonds to surface atoms.
Li-Ming Yang, Eric Ganz
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