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1.
Robert W. Baddeley Cheryl E. Praeger Csaba Schneider 《Transactions of the American Mathematical Society》2006,358(4):1619-1641
A permutation group is innately transitive if it has a transitive minimal normal subgroup, which is referred to as a plinth. We study the class of finite, innately transitive permutation groups that can be embedded into wreath products in product action. This investigation is carried out by observing that such a wreath product preserves a natural Cartesian decomposition of the underlying set. Previously we classified the possible embeddings in the case where the plinth is simple. Here we extend that classification and identify several different types of Cartesian decompositions that can be preserved by an innately transitive group with a non-abelian plinth. These different types of decompositions lead to different types of embeddings of the acting group into wreath products in product action. We also obtain a full characterisation of embeddings of innately transitive groups with diagonal type into such wreath products.
2.
Humblot V Lorenzo MO Baddeley CJ Haq S Raval R 《Journal of the American Chemical Society》2004,126(20):6460-6469
A detailed comparison of tartaric acid (HOOC-CHOH-CHOH-COOH) and succinic acid (HOOC-CH(2)-CH(2)-COOH) molecules on a Cu(110) surface is presented with a view to elucidate how the two-dimensional chirality exhibited by such robust, chemisorbed systems is affected when both OH groups of the former molecule are replaced with H groups, a stereochemical change that leaves the metal-bonding functionalities of the molecule untouched but destroys both chiral centers. It is found that this change does not significantly affect the thermodynamically preferred chemical forms that are adopted, namely the doubly deprotonated bicarboxylate at low coverages (theta = (1)/(6) ML) and the singly deprotonated monocarboxylate at higher coverage. However, the kinetics of phase formation are significantly affected so that the conditions required for self-assembling pertinent two-dimensional chiral phases alter substantially. For both molecules, two-dimensional assembly is found to depend strongly on the nature of the local adsorption motif created, with each motif essentially acting as a "synthon" for the supramolecular assembly. In this respect, it seems that molecule-metal bonding interactions define the general self-assembly structure. The presence/absence of the OH groups, instead, cause a subtler, second-order effect on the finer details of the self-assembled structure. Finally, the creation of chirality in the achiral succinate system is shown to arise from adsorption-induced asymmetrization, inducing point chirality via molecular distortion and/or metal reconstruction of the local adsorption unit. This chiral adsorption unit is then responsible for creating chiral supramolecular through-space and through-metal interactions that propagate a chiral organization. However, the achirality of the succinate ensures that nucleation points of either chirality are equally created, producing a racemic conglomerate of coexisting mirror domains. It is in this aspect that the uniquely aligned OH groups of the rigid bitartrate system wield the greatest effect, by favoring one distortion/reconstruction for the (R,R)-bitartrate and its mirror image distortion/reconstruction for the (S,S)-enantiomer, creating surfaces that are globally chiral on the macroscopic scale. So overall, the OH groups do not dictate the general nature of the assembly but are critical as chiral propagators, breaking the degeneracy and thus promoting asymmetry to chirality. 相似文献
3.
4.
Robert W. Baddeley 《Journal of Algebraic Combinatorics》1993,2(3):215-237
The paper addresses a part of the problem of classifying all 2-arc transitive graphs: namely, that of finding all groups acting 2-arc transitively on finite connected graphs such that there exists a minimal normal subgroup that is nonabelian and regular on vertices. A construction is given for such groups, together with the associated graphs, in terms of the following ingredients: a nonabelian simple group T, a permutation group P acting 2-transitively on a set , and a map F : Tsuch that x = x
–1 for all x
F() and such that Tis generated by F(). Conversely we show that all such groups and graphs arise in this way. Necessary and sufficient conditions are found for the construction to yield groups that are permutation equivalent in their action on the vertices of the associated graphs (which are consequently isomorphic). The different types of groups arising are discussed and various examples given. 相似文献
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7.
Per- and poly-substituted oligosaccharide derivatives, with trehalose cores, have been prepared and assessed for their potential for use as excipients in controlled-release formulations. The synthesized compounds, generally with acyl and amido substituents, included 6,6′-N,N′ -diamido-6,6′ -dideoxy-α,α -trehalose derivatives, 6,6′ -bis(1,2,3,4-tetra-O-acetyl-β -D-glucopyranuronyl)-α, α -trehalose derivatives, 2,2′,3,3′ -tetra-O-acetyl-6,6′ -bis-(1,2,3,4-tetra-O-acetyl-β-D-glucopyranuronyl)-4,4′ -di-O-acyl-α,α-trehalose, 2, 2′, 3, 3′ -tetra-O-acetyl-6-(1,2,3,4-tetra-O-acetyl-β-D-glucopyranuronyl)-4,4′,6′ -tri-O-acyl-α,α-trehalose, and 2,2′,3,3′,4,4′ -hexa-O-acetyl-6,6′ -bis-(1,2,3,4-tetra-O-acetyl-6-O-succinyl-β-D-glucopyranuronyl)-α,α-trehalose. Compounds were characterized by NMR, IR, MS and optical rotations; elemental analyses; or HRMS. The compounds formed amorphous materials either on fast quenching of melts or on spray drying. Properties, used in the initial assessment of the potential as controlled-release excipients, were log10 P and glass transition, Tg, values. 相似文献
8.
C. J. Baddeley A. F. Lee R. M. Lambert T. Gie el O. Schaff V. Fernandez K. -M. Schindler A. Theobald C. J. Hirschmugl R. Lindsay A. M. Bradshaw D. P. Woodruff 《Surface science》1998,400(1-3):166-175
A quantitative structure determination of a newly discovered (2×2) adsorption phase of acetylene chemisorbed on Pd{111} has been performed by scanned-energy mode photoelectron diffraction: this phase corresponds to the threshold coverage for the catalytic conversion of acetylene to benzene. The carbon atoms in the C2H2 molecule are located almost over bridge sites with a C–C bond length of 1.34+0.10 Å, the centre of the molecule being positioned almost over a hollow site. Of the two hollow sites the hcp site (directly above a second layer Pd atom) is favoured, particularly by a subset of the data most sensitive to this aspect of the structure, but the full analysis indicates that the fcc site (above a third layer Pd atom) cannot formally be excluded. The adsorption site adopted by acetylene in the higher coverage
phase on Pd{111} is essentially identical. This is the dominant structure in the coverage regime which is catalytically active for the conversion of acetylene to benzene. The implications of these findings for acetylene coupling reactions over Pd{111} are discussed. 相似文献
9.
The near monolayer depth resolution of medium energy ion scattering is utilized to develop a probe of the depth dependent composition of bimetallic nanoparticles supported on planar oxide supports. The approach fits spectra of scattered ion intensity versus ion energy at well-defined scattering angles taking into account the asymmetric line shape in such spectra and also the depth dependent loss processes encountered by incident ions as they pass through the bimetallic particles. 相似文献
10.
Adrian Baddeley Ya-Mei Chang Yong Song Rolf Turner 《Journal of computational and graphical statistics》2013,22(4):886-905
For a spatial point process model in which the intensity depends on spatial covariates, we develop graphical diagnostics for validating the covariate effect term in the model, and for assessing whether another covariate should be added to the model. The diagnostics are point-process counterparts of the well-known partial residual plots (component-plus-residual plots) and added variable plots for generalized linear models. The new diagnostics can be derived as limits of these classical techniques under increasingly fine discretization, which leads to efficient numerical approximations. The diagnostics can also be recognized as integrals of the point process residuals, enabling us to prove asymptotic results. The diagnostics perform correctly in a simulation experiment. We demonstrate their utility in an application to geological exploration, in which a point pattern of gold deposits is modeled as a point process with intensity depending on the distance to the nearest geological fault. Online supplementary materials include technical proofs, computer code, and results of a simulation study. 相似文献