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Odd electrons in molecular chemistry, surface science, and solid state magnetism
Author(s) -
Sheka E. F.
Publication year - 2007
Publication title -
international journal of quantum chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.484
H-Index - 105
eISSN - 1097-461X
pISSN - 0020-7608
DOI - 10.1002/qua.21480
Subject(s) - magnetism , fullerene , chemistry , electron , nanotechnology , nanomaterials , surface (topology) , carbon nanotube , quantum chemistry , chemical physics , materials science , physics , condensed matter physics , crystal structure , crystallography , supramolecular chemistry , quantum mechanics , organic chemistry , geometry , mathematics
A unified theoretical or computational odd‐electrons approach is suggested to nanomaterials, making possible their consideration on the same conceptual basis as well as on the same computational footing. The current paper presents the approach application to the chemistry of fullerenes, carbon single‐walled nanotubes, surface science of silicon crystal, as well as to the molecular magnetism of both molecular crystals composed of transitional metal complexes and solid polymerized fullerenes. © 2007 Wiley Periodicals, Inc. Int J Quantum Chem, 2007