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Influence of Guest−Host Interactions on the Structural, Energetic, and Mössbauer Spectroscopy Properties of Iron(II)tris(2,2′-bipyridine) in the Low-Spin and High-Spin States: A Density-Functional Theory Study of the Zeolite-Y Embedded Complex
Vargas, Alfredo, Hauser, Andreas, Lawson Daku, Latévi MaxVolume:
5
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct800284g
Date:
January, 2009
File:
PDF, 1.25 MB
english, 2009