Datta, Sambhu N.,

Theoretical and computational aspects of magnetic organic molecules /by Sambhu N. Datta (Indian Institute of Technology, Bombay, India), Carl O. Trindle (University of Virginia, USA) and Francesc Illas (Universitat de Barcelona, Spain). - London : Imperial College Press, (c)2013. - 1 online resource.

Includes bibliographies 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


Magnetochemistry.
Molecular orbitals.
Molecules--Magnetic properties.


Electronic Books.

QD591 / .T446 2013