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  • Articles  (262)
  • Institute of Physics  (154)
  • Wiley-Blackwell  (90)
  • Springer Nature  (18)
  • 1990-1994  (262)
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  • Articles  (262)
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  • 1
    Electronic Resource
    Electronic Resource
    Eigenvector and eigenvalues of some special graphs. IV. Multilevel circulants (1992)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 41 (1992), S. 105-116 
    Details
    ISSN: 0020-7608
    Keywords: Computational Chemistry and Molecular Modeling ; Atomic, Molecular and Optical Physics
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: A multilevel circulant is defined as a graph whose adjacency matrix has a certain block decomposition into circulant matrices. A general algebraic method for finding the eigenvectors and the eigenvalues of multilevel circulants is given. Several classes of graphs, including regular polyhedra, suns, and cylinders can be analyzed using this scheme.
    Additional Material: 11 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560410111
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  • 2
    Electronic Resource
    Electronic Resource
    Net signs of molecular graphs: Dependence of molecular structure (1994)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 49 (1994), S. 87-95 
    Details
    ISSN: 0020-7608
    Keywords: Computational Chemistry and Molecular Modeling ; Atomic, Molecular and Optical Physics
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: The concept of internal connectivity associates to each eigenvector of the molecular graph a graph with signed edges. We show that the respective edge signs can be deduced without knowing the graph eigenvectors. The dependence of the edge signs on molecular structure is elucidated. The sign of an edge whose end vertices are νr and νs is found to be the result of separate interactions through all paths connecting the vertices νr and νs. The analysis of the edge signs is particularly simple in the case of acyclic systems. © 1994 John Wiley & Sons, Inc.
    Additional Material: 2 Tab.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560490204
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  • 3
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    Internal friction and ultrasonic attenuation related to carriers in high T c superconductors (1993)
    Institute of Physics
    Details
    Publication Date: 1993-12-01
    Print ISSN: 1004-423X
    Topics: Physics
    Published by Institute of Physics
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    PAPER CURRENT
  • 4
    Electronic Resource
    Electronic Resource
    Syntheses of the First Selenium-Containing Bicyclic β -Lactams as Potent Antimicrobial Agents (1994)
    New York, NY : Wiley-Blackwell
    Helvetica Chimica Acta 77 (1994), S. 1037-1045 
    Details
    ISSN: 0018-019X
    Keywords: Chemistry ; Organic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Syntheses of the cis-configurated isodethiaselenapenam 5 (Scheme 1) as well as the isodethiaselenacephems 29 and 31 (Scheme 2) were accomplished, in which the key step involved addition of Se to the corresponding carbanions of 1, 25, and 27 followed by internal alkylation. β-Lactams 29 and 31 were found to possess biological activity against several pathogenic microorganisms in vitro. The electronic activation of the lactam moiety in the isodethiaselenacephem 31 and the corresponding isocephem 33 remarkably enhanced their biological activity. Isodethiaselenacephem 31 was more toxic than isocephem 33 in experimental animals.
    Additional Material: 1 Tab.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/hlca.19940770416
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  • 5
    Electronic Resource
    Electronic Resource
    Efficient Synthesis of Methyl 2-(tert-Butyl)acrylate and Analogous Esters (1994)
    New York, NY : Wiley-Blackwell
    Helvetica Chimica Acta 77 (1994), S. 1480-1484 
    Details
    ISSN: 0018-019X
    Keywords: Chemistry ; Organic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: The title products are prepared via an efficient three-step synthesis which involves hydroalumination of methyl propiolate and Lewis-acid-promoted reaction with acetone in the presence of BF3 followed by two highly selective SN2′ reactions. The key step is the reaction of 2-(chloromethyl)acrylates with R2CuLi/ZnCl2 reagents which takes place with complete allylic rearrangement.
    Additional Material: 1 Tab.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/hlca.19940770603
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  • 6
    Electronic Resource
    Electronic Resource
    Effects of Non-planarity in the Radical Anions of Tribenzo[a,c,e]cyclooctenesDedicated to Prof. Edgar Heilbronner on the occasion of his 70th birthday (1991)
    New York, NY : Wiley-Blackwell
    Helvetica Chimica Acta 74 (1991), S. 644-653 
    Details
    ISSN: 0018-019X
    Keywords: Chemistry ; Organic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Reduction of tribenzo[a,c,e]cyclooctene (2) and its 2,3- and 1,4-dimethyl derivatives (4 and 5), as well as of 1,1-dimethyl-10,11-propane-2,2-diylidene-1H-benzo[5,6]cycloocta[1,2,3,4-def]fluorene (6) and its 5,6-didehydro derivative (7) was followed by cyclic voltammetry. The radical anions of these compounds and those of their derivatives (D)2, (D)5, and (D)6, deuteratsd at C(9) in 1 and 5 or in the corresponding position of 6, have been characterized with the use of ESR, ENDOR, and TRIPLE-resonance spectroscopy. The cyclic-voltammetric and proton-hyperfine data are consistent with the increasing deviations of the radical anions from planarity in the order These deviations, due to steric or interferences in the peri-positions 1↔14 and 4↔5, are removed in and by the introduction of bridging groups. The non-plalarity affects the thermodynamic and kinetic stabilities of the radical anions and causes a shift in the π-spin distribution away from that benzene ring which is linked to the two others by the essential single bonds C(4a)—C(4b) and C(14a)—C(14b). This finding suggests that the steric hindrance in , and is alleviated by twisting this ring out of coplanarity with the remaining (Z)-stilbene-like π-system.
    Additional Material: 6 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/hlca.19910740321
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  • 7
    Electronic Resource
    Electronic Resource
    Topological analysis of eigenvalues of particle in one- and two-dimensional simple quantal systems: Net sign approach (1991)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 39 (1991), S. 59-70 
    Details
    ISSN: 0020-7608
    Keywords: Computational Chemistry and Molecular Modeling ; Atomic, Molecular and Optical Physics
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Simple net sign analysis has been carried out for particle in one- and two-dimensional boxes and harmonic oscillators. The conclusion that no simple rule for the ordering of eigenvalues of two-dimensional systems can be drawn is conjectured. Cyclobutadiene, naphthalene, benz-cyclobutadiene, biphenylene, biphenyl, and p-terphenyl are found to behave topologically as particle in either type of potential. Benzene, anthracene, naphthacene, and pentacene are found to behave topologically as particle in a two-dimensional harmonic oscillator. This analysis provides the physical basis for the net sign approach in the signed graph theory.
    Additional Material: 3 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560390108
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  • 8
    Electronic Resource
    Electronic Resource
    Non-Newtonian and isothermal analysis of flow of poly(methyl methacrylate) in a model twin screw extruder. Part I (1994)
    Stamford, Conn. [u.a.] : Wiley-Blackwell
    Polymer Engineering and Science 34 (1994), S. 986-994 
    Details
    ISSN: 0032-3888
    Keywords: Chemistry ; Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Physics
    Notes: The flow analysis network (FAN) method was modified to analyze the flow of poly(methyl methacrylate) (PMMA) in a model counter-rotating nonintermeshing screw extruder. The numerical prediction of the pressure profiles was compared with the experimental results. Flow patterns in the screw elements of the model counter-rotating nonintermeshing twin screw extruder were also predicted. A new flow path method was developed to calculate the residence time distribution. This result will be applied to analyze the flow during the reaction in the model twin screw extruder.
    Additional Material: 21 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/pen.760341207
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  • 9
    Electronic Resource
    Electronic Resource
    Conformational changes of amorphous poly(ethylene terephthalate) films during uniaxial stretching (1991)
    New York : Wiley-Blackwell
    Die Makromolekulare Chemie 192 (1991), S. 301-307 
    Details
    ISSN: 0025-116X
    Keywords: Chemistry ; Polymer and Materials Science
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Physics
    Notes: Rapid scanning Fourier transform infra-red spectroscopy was used to follow the changes in the population of trans conformers and in the infra-red dichroic functions of the bands characterizing the trans (T) and gauche (G) conformers and the chains in the amorphous regions during stretching of a solution-cast amorphous poly(ethylene terephthalate) (PET) film A in the glassy state (67°C) and in the rubbery state (88°C). Stretching at 67°C showed a yield stress peak followed by strain softening in the stress-strain curve. The population of trans conformers in the amorphous and crystalline regions, Ta + Tc, decreased in the pre-yielding region and then increased continuously after yielding. The T conformers formed during post-yield stretching showed high orientation, while the G conformers remained in low degree of orientation. Stretching at 88°C showed no pronounced yield stress peak in the stress-strain curve, and the population of T conformers did not change until the beginning strain-induced crystallization. A solvent-cast PET film annealed at 67°C for 24 h, the film N, showed a sharp and high yield stress peak in the stress-strain curve, and strain-induced crystallization occurred at lower draw ratio as compared to the film A. The film A showed a non-equilibrium high population of Ta conformers, part of which reverted to G conformers during sub-Tg annealing.
    Additional Material: 4 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/macp.1991.021920212
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  • 10
    Electronic Resource
    Electronic Resource
    Robust principal component analysis by projection pursuit (1993)
    New York, NY : Wiley-Blackwell
    Journal of Chemometrics 7 (1993), S. 527-541 
    Details
    ISSN: 0886-9383
    Keywords: Principal component analysis ; Projection pursuit ; Simulated annealing algorithm ; Robust statistics ; Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Principal component analysis (PCA) is a widely used technique in chemometrics. The classical PCA method is, unfortunately, non-robust, since the variance is adopted as the objective function. In this paper, projection pursuit (PP) is used to carry out PCA with a criterion which is more robust than the variance. In addition, the generalized simulated annealing (GSA) algorithm is introduced as an optimization procedure in the process of PP calculation to guarantee the global optimum. The results for simulated data sets show that PCA via PP is resistant to the deviation of the error distribution from the normal one. The method is especially recommended for use in cases with possible outlier(s) existing in the data.
    Additional Material: 7 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/cem.1180070606
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