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1.
Molecular electroactive monolayers have been produced from vinylferrocene (VFC) via light-assisted surface anchoring to H-terminated n- and p-Si(1 0 0) wafers prepared via wet chemistry, in a controlled atmosphere. The resulting Si-C bound hybrids have been characterized by means of XPS and AFM. Their performance as semiconductor functionalized electrodes and their surface composition have been followed by combining electrochemical and XPS measurements on the same samples, before and after use in an electrochemical cell. White-light photoactivated anchoring at short (1 h) exposure times has resulted in a mild route, with a very limited impact on the initial quality of the silicon substrate. In fact, the functionalized Si surface results negligibly oxidized, and the C/Fe atomic ratio is close to the value expected for the pure molecular species. The VFC/Si hybrids can be described as (η5-C5H5)Fe2+(η5-C5H4)-CH2-CH2-Si species, on the basis of XPS results. Electrochemical methods have been applied in order to investigate the role played by a robust, covalent Si-C anchoring mode towards substrate-molecule electronic communication, a crucial issue for a perspective development of molecular electronics devices. The response found from cyclic voltammograms for p-Si(1 0 0) functionalized electrodes, run in the dark and under illumination, has shown that the electron transfer is not limited by the number of charge carriers, confirming the occurrence of electron transfer via the Si valence band. The hybrids have shown a noticeable electrochemical stability and reversibility under cyclic voltammetry (cv), and the trend in peak current intensity vs. the scan rate was linear. The molecule-Si bond is preserved even after thousands of voltammetric cycles, although the surface coverage, evaluated from cv and XPS, decreases in the same sequence. An increasingly larger surface concentration of Fe3+ at the expenses of Fe2+ redox centers has been found at increasing number of cv’s, experimentally associated with the growth of silicon oxide. Surface SiO− groups from deprotonated silanol termination, induced by the electrochemical treatments, are proposed as the associated counterions for the Fe3+ species. They could be responsible for the observed decrease in the electron transfer rate constant with electrode ageing. 相似文献
2.
In this paper we give necessary and sufficient conditions for the existence of a C>
0-semigroup in L
1(I) (I real interval) generated by a second-order differential operator when suitable boundary conditions at the endpoints are imposed. 相似文献
3.
We deal with the problem of determining an inclusion within an electrostatic conductor from boundary measurements. Under mild a priori assumptions we establish optimal stability estimates. Measurements are performed on a portion of the boundary of the conductor. 相似文献
4.
5.
Alberto Caprara Andrea Lodi Silvano Martello Michele Monaci 《Discrete Optimization》2006,3(4):317-326
We address the problem of packing a given set of rectangles into the minimum size square. We consider three versions of the problem, arising when the rectangles (i) are squares; (ii) have a fixed orientation; (iii) can be rotated by 90. For each case we study lower bounds, and analyze their worst-case performance ratio. In addition, we evaluate through computational experiments their average performance on instances from the literature. 相似文献
6.
Nicola Fusco Michele Gori Francesco Maggi 《NoDEA : Nonlinear Differential Equations and Applications》2006,13(4):425-433
An approximation theorem for families of weakly coercive convex functions by means of countably many smooth families of convex
functions is proved. As a consequence, the classical “three-fold” lower semicontinuity theorem for integral functionals of
the Calculus of Variations by James Serrin is unified in one single statement. 相似文献
7.
A path-integral molecular dynamics technique for strongly interacting atoms using ab initio potentials derived from density functional theory is implemented. This allows the efficient inclusion of nuclear quantum dispersion in ab initio simulations at finite temperatures. We present an application to the quantum cluster H
5
+
. 相似文献
8.
Michele Ciarletta 《Journal of Elasticity》1995,39(3):229-246
This paper is concerned with the dynamic theory of a binary mixture consisting of a gas and an elastic solid. First, we derive general theorems (reciprocal theorem, uniqueness theorem, minimum principle). The, we establish a Galerkin representation and the fundamental solutions in the case of steady vibrations.Work performed under the auspices of G.N.F.M. of the Italian Research Council (C.N.R.), with the grant 60% M.U.R.S.T. (ITALY). 相似文献
9.
10.
Alexis C. Kaporis Lefteris M. Kirousis Yannis C. Stamatiou Malvina Vamvakari Michele Zito 《Discrete Applied Mathematics》2007,155(12):1525-1538
The problem of determining the unsatisfiability threshold for random 3-SAT formulas consists in determining the clause to variable ratio that marks the experimentally observed abrupt change from almost surely satisfiable formulas to almost surely unsatisfiable. Up to now, there have been rigorously established increasingly better lower and upper bounds to the actual threshold value. In this paper, we consider the problem of bounding the threshold value from above using methods that, we believe, are of interest on their own right. More specifically, we show how the method of local maximum satisfying truth assignments can be combined with results for the occupancy problem in schemes of random allocation of balls into bins in order to achieve an upper bound for the unsatisfiability threshold less than 4.571. In order to obtain this value, we establish a bound on the q-binomial coefficients (a generalization of the binomial coefficients). No such bound was previously known, despite the extensive literature on q-binomial coefficients. Finally, to prove our result we had to establish certain relations among the conditional probabilities of an event in various probabilistic models for random formulas. It turned out that these relations were considerably harder to prove than the corresponding ones for unconditional probabilities, which were previously known. 相似文献