Datta, Sambhu N.

Theoretical and computational aspects of magnetic organic molecules / Sambhu N. Datta (Indian Institute of Technology, Bombay, India), Carl O. Trindle (University of Virginia, USA), Francesc Illas (Universitat de Barcelona, Spain). - 1 online resource (346 pages) : illustrations

Includes bibliographical references and index.

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.

9781908977229 (e-book)


Magnetochemistry.
Molecular orbitals.
Molecules--Magnetic properties.


Electronic books.

QD591 / .D38 2014eb

541/.378