Theoretical and computational aspect...
Datta, Sambhu N.

 

  • Theoretical and computational aspects of magnetic organic molecules[electronic resource] /
  • 紀錄類型: 書目-電子資源 : Monograph/item
    杜威分類號: 541/.378
    書名/作者: Theoretical and computational aspects of magnetic organic molecules/ Sambhu N Datta, Carl O. Trindle, Francesc Illas.
    作者: Datta, Sambhu N.
    其他作者: Trindle, Carl.
    出版者: London : : Imperial College Press ;, c2014.
    面頁冊數: 1 online resource (x, 335 p.) : : ill.
    標題: Magnetochemistry.
    標題: Molecular orbitals.
    標題: Molecules - Magnetic properties.
    ISBN: 9781908977229
    書目註: Includes bibliographical references (p. 327-328) and index.
    內容註: Introduction to magnetism -- Organic molecules, radicals, and spin states -- Theoretical methodologies -- Molecular orbital description of magnetic organic systems -- Qualitative methods for predicting molecular spin states -- Quantum chemical calculations: structural trends -- Strongly coupled magnetic molecules -- Photomagnetic effects -- Transition metal complexes -- Computational studies of inorganic clusters and solid -- Systems -- A look ahead.
    電子資源: http://www.worldscientific.com/worldscibooks/10.1142/p885#t=toc
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