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- W336444307 abstract "A calculation of the electronic structure and the quadrupole splitting (QS) in the Moessbauer spectra of the model complexes (Fe(RCOCHCOR)/sub 3/) has been carried out by the semiempirical INDO method. It has been shown that the values of the QS in complexes with symmetric ligands and equivalent Fe-O bonds is not zero and that the weak dependence of the QS on the nature of R is due to the fact that the changes in the valence and lattice contributions to the QS compensate one anther." @default.
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- W336444307 date "1988-06-01" @default.
- W336444307 modified "2023-09-23" @default.
- W336444307 title "Model quantum-chemical investigation of the nature of the quadrupole splitting Moessbauer spectra of iron(III) tris(. beta. -diketonates)" @default.
- W336444307 hasPublicationYear "1988" @default.
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