Articles with "structure description" as a keyword



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Optical and electronic structure description of metal-doped phthalocyanines

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Published in 2017 at "Journal of Molecular Modeling"

DOI: 10.1007/s00894-017-3338-4

Abstract: AbstractPhthalocyanines represent a crucial class of organic compounds with high technological appeal. By doping the center of these systems with metals, one obtains the so-called metal-phthalocyanines, whose property of being an effective electron donor allows… read more here.

Keywords: structure description; electronic structure; optical electronic; description metal ... See more keywords

The Structure of Description: Evaluating Descriptive Inferences and Conceptualizations

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Published in 2019 at "Perspectives on Politics"

DOI: 10.1017/s1537592718001068

Abstract: Explanation presumes description. Description explores the who, when, where, and how, and its answers furnish the raw material for theorizing and explaining. This connection between description and allegedly serendipitous exploration contributed to the notion that… read more here.

Keywords: description; structure description; description evaluating; descriptive inferences ... See more keywords
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2,2′:4,4′′:4′,4′′′-Quaterpyridine: synthesis, crystal-structure description, and Hirshfeld surface analysis

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Published in 2023 at "Acta Crystallographica Section E: Crystallographic Communications"

DOI: 10.1107/s2056989023002426

Abstract: The title compound, 2,2′:4,4′′:4′,4′′′-quaterpyridine (Qtpy), C20H14N4, crystallizes in the triclinic P space group and has half of the molecule in the asymmetric unit, corresponding to 4,4′-bipyridine (4,4′-bpy) that serves as the building block for the… read more here.

Keywords: quaterpyridine synthesis; synthesis crystal; description hirshfeld; structure description ... See more keywords