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Strength of Spin Coupling in High-Spin Organic Molecules

✍ Scribed by Li, Shuhua; Ma, Jing; Jiang, Yuansheng


Book ID
126088625
Publisher
American Chemical Society
Year
1997
Tongue
English
Weight
163 KB
Volume
101
Category
Article
ISSN
1089-5639

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Spin alignment in organic high-spin molecules with both unpaired II and non-bonding electrons of carbene has been studied with the help of exact numerical diagonalization of the Heisenberg Hamiltonian. This approach predicts correct spin states and their relative energy gaps of high-spin molecules n

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