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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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The Born scattering approximation has been widely used in seismology to study scattered waves, and to linearize the propagation problem for inversion. The standard Born theory requires the model be separated into a smooth, reference model and a perturbation. Scattering occurs from the pertubation. In the distorted Born approximation, when the reference model is inhomogeneous, the reference Green's functions are normally not known exactly, but the error in these Green's functions is rarely quantified. In this paper, we generalize Born scattering theory to include the errors in the Green's functions explicitly, and obtain scattering integrals from these errors. For forward modelling, there is no need to separate the model into a reference and perturbation part - approximate Green's functions in the true model can be used to calculate the scattered signals.
The theory is developed for inhomogeneous, anisotropic media. Asymptotic ray theory results are suitable approximate Green's functions for the generalized Born scattering theory. The error terms are simple, easily calculated and included in the scattering integrals. Various applications of generalized Born scattering theory have already appeared in the literature, e.g. quasi-shear ray coupling, and this paper is restricted to an improved and more complete theoretical development. Further applications will appear elsewhere. 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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Soderstrom E McKenna JA Abrams GS Adolphsen CE Averill D Ballam J Barish BC Barklow T Barnett BA Bartelt J Bethke S Blockus D Bonvicini G Boyarski A Brabson B Breakstone A Bulos F Burchat PR Burke DL Cence RJ Chapman J Chmeissani M Cords D Coupal DP Dauncey P DeStaebler HC Dorfan DE Dorfan JM Drewer DC Elia R Feldman GJ Fernandes D Field RC Ford WT Fordham C Frey R Fujino D Gan KK Gero E Gidal G Glanzman T Goldhaber G Gomez Cadenas JJ Gratta G Grindhammer G Grosse-Wiesmann P Hanson G Harr R 《Physical review letters》1990,64(25):2980-2983
7.
Komamiya S Abrams GS Adolphsen CE Averill D Ballam J Barish BC Barklow T Barnett BA Bartelt J Bethke S Blockus D Bonvicini G Boyarski A Brabson B Breakstone A Bulos F Burchat PR Burke DL Cence RJ Chapman J Chmeissani M Cords D Coupal DP Dauncey P DeStaebler HC Dorfan DE Dorfan JM Drewer DC Elia R Feldman GJ Fernandes D Field RC Ford WT Fordham C Frey R Fujino D Gan KK Gatto C Gero E Gidal G Glanzman T Goldhaber G Gomez Cadenas JJ Gratta G Grindhammer G Grosse-Wiesmann P Hanson G Harr R 《Physical review letters》1990,64(24):2881-2884
8.
Wagner SR Hinshaw DA Ong RA Snyder A 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 《Physical review letters》1990,64(10):1095-1098
9.
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
10.
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