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1.
Lithium Insertion Mechanism in Iron-Based Oxyfluorides with Anionic Vacancies Probed by PDF Analysis
Dr. Damien Dambournet Dr. Karena W Chapman Dr. Mathieu Duttine Dr. Olaf Borkiewicz Dr. Peter J Chupas Dr. Henri Groult 《ChemistryOpen》2015,4(4):443-447
The mechanism of lithium insertion that occurs in an iron oxyfluoride sample with a hexagonal–tungsten–bronze (HTB)-type structure was investigated by the pair distribution function. This study reveals that upon lithiation, the HTB framework collapses to yield disordered rutile and rock salt phases followed by a conversion reaction of the fluoride phase toward lithium fluoride and nanometer-sized metallic iron. The occurrence of anionic vacancies in the pristine framework was shown to strongly impact the electrochemical activity, that is, the reversible capacity scales with the content of anionic vacancies. Similar to FeOF-type electrodes, upon de-lithiation, a disordered rutile phase forms, showing that the anionic chemistry dictates the atomic arrangement of the re-oxidized phase. Finally, it was shown that the nanoscaling and structural rearrangement induced by the conversion reaction allow the in situ formation of new electrode materials with enhanced electrochemical properties. 相似文献
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A rooted graph is a pair (G,x), where G is a simple undirected graph and x ∈ V(G). If G is rooted at x, its kth rotation number hk (G,x) is the minimum number of edges in a graph F of order |G| + k such that for every v ∈ V(F) we can find a copy of G in F with the root vertex x at v. When k = 0, this definition reduces to that of the rotation number h(G,x), which was introduced in [“On Rotation Numbers for Complete Bipartite Graphs,” University of Victoria, Department of Mathematics Report No. DM-186-IR (1979)] by E.J. Cockayne and P.J. Lorimer and subsequently calculated for complete multipartite graphs. In this paper, we estimate the kth rotation number for complete bipartite graphs G with root x in the larger vertex class, thereby generalizing results of B. Bollobás and E.J. Cockayne [“More Rotation Numbers for Complete Bipartite Graphs,” Journal of Graph Theory, Vol. 6 (1982), pp. 403–411], J. Haviland [“Cliques and Independent Sets,” Ph. D. thesis, University of Cambridge (1989)], and J. Haviland and A. Thomason [“Rotation Numbers for Complete Bipartite Graphs,” Journal of Graph Theory, Vol. 16 (1992), pp. 61–71]. © 1993 John Wiley & Sons, Inc. 相似文献
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Weir AJ Klein SR Abrams G Adolphsen CE Akerlof C Alexander JP Alvarez M Amidei D Baden AR Ballam J Barish BC Barklow T Barnett BA Bartelt J Blockus D Bonvicini G Boyarski A Boyer J Brabson B Breakstone A Brom JM Bulos F Burchat PR Burke DL Butler F Calvino F Cence RJ Chapman J Cords D Coupal DP DeStaebler HC Dorfan DE Dorfan JM Drell PS Feldman GJ Fernandez E Field RC Ford WT Fordham C Frey R Fujino D Gan KK Gidal G Gladney L Glanzman T Gold MS Goldhaber G Green A Grosse-Wiesmann P Haggerty J 《Physical review D: Particles and fields》1990,41(5):1384-1388
6.
Mathiazhagan C Molzon WR Cousins RD Konigsberg J Kubic J Melese P Rubin P Slater WE Wagner D Hart GW Kinnison WW Lee DM McKee RJ Milner EC Sanders GH Ziock HJ Arisaka K Knibbe P Urheim J Axelrod S Biery KA Irwin GM Lang K Margulies J Ouimette DA Ritchie JL Trang QH Wojcicki SG Auerbach LB Buchholz P Highland VL McFarlane WK Sivertz M Chapman MD Eckhause M Ginkel JF Hancock AD Joyce D Kane JR Kenney CJ Vulcan WF Welsh RE Whyley RJ Winter RG 《Physical review letters》1989,63(20):2181-2184
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Abachi S Baringer P Bylsma BG DeBonte R Koltick D Loeffler FJ Low EH McIlwain RL Miller DH Ng CR Rangan LK Shibata EI Derrick M Gan KK Kooijman P Loos JS Musgrave B Price LE Repond J Sugano K Weiss JM Wood DE Blockus D Brabson B Brom J Jung C Ogren H Rust DR Akerlof C Chapman J Errede D Kesten P Meyer DI Nitz D Seidl AA Thun R Willutzky M Cork B 《Physical review letters》1986,57(16):1990-1993
8.
R. J. Smith P. J. Woods R. Chapman J. L. Durell J. N. Mo B. R. Fulton R. A. Cunningham 《Zeitschrift für Physik A Hadrons and Nuclei》1986,324(3):283-287
The ground-state masses of35Si and34Si have been measured using the reactions64Ni(36S,35,34Si)65,66Zn at a36S beam energy of 198 MeV.34,35Si14+ ions were analysed and identified in a QMG/2 magnetic spectrometer and gas-filled focal-plane detector. The experimental mass excess of35Si was determined to be ?14.58± 0.12 0.07 MeV while that of34Si was measured as ?19.961±0.034 MeV. A comparison is made with the results of mass model predictions. 相似文献
9.
P. Colombo L. E. Kukacka J. Fontana R. N. Chapman M. Steinberg 《Journal of polymer science. Part A, Polymer chemistry》1966,4(1):29-57
The γ-radiation-induced free-radical copolymerization of ethylene and CO has been investigated over a wide range of pressure, initial gas composition, radiation intensity, and temperature. At 20°C., concentrations of CO up to 1% retard the polymerization of ethylene. Above this concentration the rate reaches a maximum between 27.5 and 39.2% CO and then decreases. The copolymer composition increases only from 40 to 50% CO when the gas mixture is varied from 5 to 90% CO. A relatively constant reactivity ratio is obtained at 20°C., indicating that CO adds 23.6 times as fast as an ethylene monomer to an ethylene free-radical chain end. For a 50% CO gas mixture, the above value of 23.6 and the copolymerization rate decrease with increasing temperature to 200°C. The kinetic data indicate a temperature-dependent depropagation reaction. Infrared examination of copolymers indicates a polyketone structure containing ? CH2? CH2? and ? CO? units. The crystalline melting point increases rapidly from 111 to 242°C., as the CO concentration in the copolymer increases from 27 to 50%. Molecular weight of copolymer formed at 20°C. increased with increasing CO, indicating M?n values >20,000. Increasing reaction temperature results in decreasing molecular weight. Onset of decomposition for a 50% CO copolymer was measured at ≈250°C. 相似文献
10.
Herein we describe a strategy for the preparation of artificial alpha-helices involving replacement of one of the main-chain hydrogen bonds with a covalent linkage. To mimic the C=O...H-N hydrogen bond as closely as possible, we envisioned a covalent bond of the type C=X-Y-N, where X and Y are two carbon atoms connected through an olefin metathesis reaction. Our results demonstrate that the replacement of a hydrogen bond between the i and i + 4 residues at the N-terminus of a short peptide with a carbon-carbon bond results in a highly stable constrained alpha-helix at physiological conditions as indicated by CD and NMR spectroscopies. The advantage of this strategy is that it allows access to short alpha-helices with strict preservation of molecular recognition surfaces required for biomolecular interactions. 相似文献