Computationally inexpensive interpretation of magnetic data for finite spin clusters

Research output: Contribution to journalJournal articleResearchpeer-review

We show that high-temperature expansion of the partition function is a computationally convenient tool to interpretation of magnetic properties of spin clusters wherein the spin centers are interacting via an isotropic Heisenberg exchange operator. High-temperature expansions up to order 12 are used to reproduce temperature dependent magnetic susceptibilities of a Cr(iii) tetramer, a decanuclear Fe(iii) wheel, a 3x3 grid arrangement of nine Mn(ii) ions, and a dodecanuclear Ni(ii) wheel. Excellent agreement with experiments as well as with results from computationally more elaborate methods is achieved.
Original languageEnglish
JournalDalton Transactions (Print Edition)
Volume39
Issue number20
Pages (from-to)4882-5
Number of pages3
ISSN1477-9226
DOIs
Publication statusPublished - 2010

ID: 20542970