NUCLEAR RESONANT SCATTERING AND MOLECULAR-ORBITAL CALCULATIONS ON AN IRON(II) SPIN-CROSSOVER COMPLEX

Authors
GRUNSTEUDEL H PAULSEN H MEYERKLAUCKE W WINKLER H TRAUTWEIN AX GRUNSTEUDEL HF BARON AQR CHUMAKOV AI RUFFER R TOFTLUND H
Citation
H. Grunsteudel et al., NUCLEAR RESONANT SCATTERING AND MOLECULAR-ORBITAL CALCULATIONS ON AN IRON(II) SPIN-CROSSOVER COMPLEX, Hyperfine interactions, 113(1-4), 1998, pp. 311-317
Citations number
22
Categorie Soggetti
Physics, Atomic, Molecular & Chemical","Physics, Nuclear","Physics, Condensed Matter
Journal title
Hyperfine interactions → ACNP
ISSN journal
03043843
Volume
113
Issue
1-4
Year of publication
1998
Pages
311 - 317
Database
ISI
SICI code
0304-3843(1998)113:1-4<311:NRSAMC>2.0.ZU;2-X
Abstract
Nuclear resonant scattering of synchrotron radiation was applied to in vestigate the spin-crossover complex Fe(tpa)(NCS)(2) (tpa = tris(2-pyr idylmethyl)amine). The nuclear forward scattering experiments are comp ared with conventional Mossbauer experiments, and the nuclear inelasti c scattering experiments are compared with the results from a theoreti cal normal mode analysis based on molecular orbital calculations.