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921.
An approach for the analysis of large experimental datasets in electrochemical impedance spectroscopy (EIS) has been developed. The approach uses the idea of successive Bayesian estimation and splits the multidimensional EIS datasets into parts with reduced dimensionality. Afterwards, estimation of the parameters of the EIS-models is performed successively, from one part to another, using complex nonlinear least squares (CNLS) method. The results obtained on the previous step are used as a priori values (in the Bayesian form) for the analysis of the next part. To provide high stability of the sequential CNLS minimisation procedure, a new hybrid algorithm has been developed. This algorithm fits the datasets of reduced dimensionality to the selected EIS models, provides high stability of the fitting and allows semi-automatic data analysis on a reasonable timescale. The hybrid algorithm consists of two stages in which different zero-order optimisation strategies are used, reducing both the computational time and the probability to overlook the global optimum. The performance of the developed approach has been evaluated using (i) simulated large EIS dataset which represents a possible output of a scanning electrochemical impedance microscopy experiments, and (ii) experimental dataset, where EIS spectra were acquired as a function of the electrode potential and time. The developed data analysis strategy showed promise and can be further extended to other electroanalytical EIS applications which require multidimensional data analysis. 相似文献
922.
Robert A. Valentine Alexander Whyte Kunio Awaga Neil Robertson 《Tetrahedron letters》2012,53(6):657-660
We have prepared two new C3-symmetric, substituted-triazatruxene molecules using a facile one-pot trimerisation of 5-carboxyindole and 6-bromoindole in acetic acid using Br2, giving 2a and 3a, respectively. These were subsequently modified by the addition of six alkyl chains to the N- and carboxyl-positions of 2a giving 2b and three alkyl chains to the N-positions of 3a giving 3b. The new molecules were characterised using cyclic voltammetry, UV/vis and emission spectroscopy, DFT calculations and in the case of 3b, field-effect transistor measurements showing gate-modulated source-drain current. These represent a straightforward route to large polyaromatic molecules with easily-modified side groups and are suitable as building blocks for synthesis of functional molecules for materials. 相似文献
923.
Rasheed Ahmad Khera Munawar Hussain Nguyen Thai Hung Nadi Eleya Holger Feist Alexander Villinger Peter Langer 《Helvetica chimica acta》2012,95(3):469-482
Suzuki? Miyaura reactions of 2,3‐dibromo‐1H‐inden‐1‐one afforded a wide range of arylated 1H‐inden‐1‐ones. Sonogashira cross‐coupling reactions gave alkynylated indenones. The reactions proceeded with very good regioselectivity in the less sterically hindered and more electron‐deficient position 3. 相似文献
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928.
Conversion-type electrode materials are discussed in this critical review. Most of the conversion materials are significantly less expensive than modern intercalation-type materials, and the materials involved are appreciably abundant in the nature. However, up to now, no practically viable battery with conversion material-based electrodes was reported, as there are several major barriers to a practical employment of these materials. First, material utilization and cell energy performance are seriously compromised by a low conductivity of the most conversion materials and by a substantial electrolyte involvement in the electrochemical process. Second, the conversion reactions usually demonstrate a severe volume effect, and also conversion electrodes interact with electrolyte developing thick and resistant solid electrolyte interphase films; both of these features result in impractically low electrode cyclability. Third, a large lithiation/de-lithiation voltage hysteresis results in impractically low charge/discharge energy efficiency and suggests a severe battery heating in the course of the battery operation. All these problems present serious challenges for the researchers in the field; the approaches for handling these issues are discussed in the review. For the foreseeable future, there are grounds to expect progress in tackling some of these issues. The issue of high voltage hysteresis is a bottleneck, though, and it actually precludes conversion materials from any practical application. 相似文献
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