Lamonova K. Spin and orbital states of paramagnetic ions in deformed coordination complexes: modified crystal field theory

Українська версія

Thesis for the degree of Doctor of Science (DSc)

State registration number

0515U000889

Thesis Registration Form

0515U000889.pdf

Applicant for

Specialization

  • 01.04.07 - Фізика твердого тіла

27-10-2015

Specialized Academic Board

Д 64.175.03

B. Verkin Institute for Low Temperature Physics and Engineering of the National Academy of Sciences of Ukraine

Essay

A new calculation method, called modified crystal field theory (MCFT), to find electronic levels of transition and rare-earth ions placed in coordination complexes with different chemical nature and symmetry has been proposed. It is based on the traditional crystal-field theory and a new parameterization which uses the effective nuclear charge of a paramagnetic ion. The method of spin-state diagram calculations has been proposed. This method and possibility to vary coordination-complex parameters allows to study spin-state fluctuations in a paramagnetic ion. MCFT gives possibility to take into account the interaction of paramagnetic ions with an external magnetic field. Due to this option it was possible to interpret successfully EPR spectra.

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Files

aref.pdf

diss.pdf

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