Bipyridine and phenanthroline IR-spectral bands as indicators of metal spin state in hexacoordinated complexes of Fe(ii), Ni(ii) and Co(ii)

Spin crossover transition of Fe(phen)2(NCS)2: periodic dispersion-corrected density-functional study

(2012) Tomáš Bučko et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Variable temperature IR spectroscopy and quantum chemistry as the tool for diagnostics of metal spin state

(2010) T.P. Griaznova et al.   CHEMICAL PHYSICS LETTERS

DFT study of substitution effect on the geometry, IR spectra, spin state and energetic stability of the ferrocenes and their pentaphospholyl analogues

(2010) Tatyana P. Gryaznova et al.   JOURNAL OF ORGANOMETALLIC CHEMISTRY

Ab Initio and DFT Predictions of Infrared Intensities and Raman Activities

(2010) Elena E. Zvereva et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Two new Fe(II) spin crossover complexes with tetrazol-1-yl-cycloalkane ligands

(2009) Nader Hassan et al.   INORGANICA CHIMICA ACTA

Electrochemical properties of n-sulfonatothiacalyx[4]arene complexes with Fe3+ and [Co(dipy)3]3+ ions

(2009) N. V. Nastapova et al.   RUSSIAN JOURNAL OF ELECTROCHEMISTRY

Modeling spin-crossover compounds by periodicDFT+Uapproach

(2008) S. Lebègue et al.   PHYSICAL REVIEW B