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  • 1
    Electronic Resource
    Electronic Resource
    Theoretical investigations of the interaction of isobutene with sodium ions (1982)
    s.l. : American Chemical Society
    The @journal of physical chemistry 〈Washington, DC〉 86 (1982), S. 3269-3271 
    Details
    Source: ACS Legacy Archives
    Topics: Chemistry and Pharmacology , Physics
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1021/j100213a038
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  • 2
    Electronic Resource
    Electronic Resource
    Inoculation of Guinea pigs with varicella-zoster virus via the respiratory route (1986)
    Springer
    Archives of virology 88 (1986), S. 265-277 
    Details
    ISSN: 1432-8798
    Source: Springer Online Journal Archives 1860-2000
    Topics: Medicine
    Notes: Summary Guinea pigs were inoculated by the respiratory route with wild-type (Cyr) or vaccine (Oka) strain varicella zoster virus (VZV). Wild-type cell-free virus obtained by sonication produced neutralizing antibody responses in steroid-treated animals when given via the intratracheal route, and induced neutralizing antibody as well as a pneumonitis in normal animals when given via the intrabronchial (i. b.) route. A humoral response also followed i.b. instillation of cell-associated wild-type or vaccine strain VZV. Prior i.b. administration of thioglycollate or exposure to hyperoxia altered the number and function of pulmonary macrophages, respectively, but viral susceptibility of the guinea pigs was not enhanced. Both strains of VZV could be isolated from bronchial washings up to 48 hours after i.b. instillation of cell-associated virus, but neither strain was isolated thereafter from cultures of bronchial washings or explanted lung tissues.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1007/BF01310880
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  • 3
    Electronic Resource
    Electronic Resource
    Übersetzung von Kommandosprachen (1975)
    Springer
    Computing 14 (1975), S. 271-284 
    Details
    ISSN: 1436-5057
    Source: Springer Online Journal Archives 1860-2000
    Topics: Computer Science
    Description / Table of Contents: Abstract Load-sharing computer networks require the portability of command languages. This can be achieved by the standardization or by the translation of command languages. The structure and the way of acting of a command language translator is given which is suitable for the translation of a specific class of command programs and which consists of a languageindependent program working on language dependent tables. An example is given for the translation of a command program.
    Notes: Zusammenfassung Der Einsatz von lastausgleichenden Rechnerverbundsystemen erfordert die Übertragbarkeit von Kommandosprachen. Diese kann durch die Standardisierung oder die Übersetzung von Kommandosprachen erreicht werden. Es wird der Aufbau und die Wirkungsweise eines für eine bestimmte Klasse von Kommandoprogrammen geeigneten Kommandosprachenübersetzers angegeben, der aus einem sprachunabhängigen Programm besteht, das auf sprachabhängige Tabellen arbeitet. Ein Beispiel für die Übersetzung eines Kommandoprogramms wird angegeben.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1007/BF02246432
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  • 4
    Electronic Resource
    Electronic Resource
    Calculation of periodic molecular systems with perturbed periodicity within the PCILO framework. I. Method (1982)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 21 (1982), S. 711-716 
    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 method within the PCILO framework for the study of periodic molecular systems involving impurities is described regarding a one-dimensional chain. The calculation of the whole system is reduced to the calculation of subsystem pairs only. By use of the first-neighbor approximation only one or two subsystem pairs must be considered for subsystems with identical or differing surroundings, respectively. The procedure described yields the ground state energies and charge distributions of the subsystems.
    Additional Material: 1 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560210405
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  • 5
    Electronic Resource
    Electronic Resource
    A modified PCILO framework using the CNDO/Boyd-Whitehead parametrization (1984)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 25 (1984), S. 1055-1060 
    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 CNDO/BW modification of the CNDO/2 approximation was used within the PCILO framework. It was shown on some significant examples that all the good results of the original PCILO-CNDO/2 method can be reproduced by the modified version PCILO-CNDO/BW at least. Thus, preserving the quality of its results a computer-expense-reduced PCILO method is proposed for calculations on large molecular systems.
    Additional Material: 1 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560250610
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  • 6
    Electronic Resource
    Electronic Resource
    Calculation of periodic molecular systems with perturbed periodicity within the PCILO framework. II. Model systems (1984)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 25 (1984), S. 1061-1067 
    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 energetic behavior of one-dimensional (HF)n and (H2O)n chains with added or inserted H2O or HF was studied by means of the PCILOPSI method presented in Part I. The results were compared with the ones by the original PCILO method. The stabilization energies are in good qualitative agreement; energy differences due to impurity effects even quantitatively agree. The results show that the PCILOPSI method is well suited for the study of perturbed periodic molecular systems.
    Additional Material: 1 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560250611
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  • 7
    Electronic Resource
    Electronic Resource
    PCILO calculations on hydrogen bonded complexes. Dimers involving second row atoms (1977)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 12 (1977), S. 805-811 
    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 PCILO method was used to study systems with the following types of intermolecular hydrogen bonds, involving 2nd row atoms: N…H—S, S…H—S, N…H—Cl, Cl…H—F, Cl…H—Cl, P…H—N, P…H—P, P…H—F, S…H—F.In all the cases calculated, the PCILO method yields an accurate qualitative description of the stabilization energies and to some extent quantitatively good agreement with reliable ab initio and experimental results. The corresponding equilibrium distances are in almost all cases smaller (up to 0.6 Å) than the ab initio values of the same compounds.
    Additional Material: 2 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560120504
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  • 8
    Electronic Resource
    Electronic Resource
    Steady states and quasienergies of a system in an oscillating field within the perturbation configuration interaction method (1981)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 19 (1981), S. 163-170 
    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 perturbation configuration interaction method is formulated for a system in an external oscillating field (PCILOSC). It is closely connected with the static PCILO method and can be used for the conformational analysis of molecules and molecular crystals with localized bonds in external fields.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560190114
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  • 9
    Electronic Resource
    Electronic Resource
    Calculation of systems involving strong delocalized bonds within a modified PCILO framework. I. Valence-bond PCILO method (1984)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 25 (1984), S. 475-481 
    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: In describing mesomer structures by the original PCILO method several problems may occur because of the use of localized bonds. A so-called VB-PCILO including a superposition of several mesomer boundary structures in the CI perturbation treatment will be proposed.
    Additional Material: 1 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560250303
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  • 10
    Electronic Resource
    Electronic Resource
    An improved description of lone pairs by a modified PCILO method (1982)
    New York, NY [u.a.] : Wiley-Blackwell
    Journal of Computational Chemistry 3 (1982), S. 507-511 
    Details
    ISSN: 0192-8651
    Keywords: Computational Chemistry and Molecular Modeling ; Biochemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Computer Science
    Notes: The inadequate description of molecular systems involving lone pairs by the original PCILO method is analyzed on some examples. A modified PCILO version for the lone-pair description is proposed. The success of this method is represented in the same examples.
    Additional Material: 3 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/jcc.540030408
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