Theoretical studies of the optical and EPR spectra for VO²⁺ in Na₃C₆H₅O₇·2H₂O single crystal

On the basis of the perturbation formulas for a d¹ configuration ion in a tetragonal crystal field, the three optical absorption bands and electron paramagnetic resonance (EPR) parameters (g factors gi and hyperfine structure constants Ai for i = || and ⊥, respectively) of VO²⁺ in Na₃C₆H₅O₇·2H₂O sin...

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Бібліографічні деталі
Дата:2015
Автори: Li, Ch.-Y., Wang, G.-X., Zheng, X.-M.
Формат: Стаття
Мова:English
Опубліковано: Інститут фізики конденсованих систем НАН України 2015
Назва видання:Condensed Matter Physics
Онлайн доступ:http://dspace.nbuv.gov.ua/handle/123456789/153583
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Назва журналу:Digital Library of Periodicals of National Academy of Sciences of Ukraine
Цитувати:Theoretical studies of the optical and EPR spectra for VO²⁺ in Na₃C₆H₅O₇·2H₂O single crystal / Ch.-Y. Li, G.-X. Wang, X.-M. Zheng // Condensed Matter Physics. — 2015. — Т. 18, № 2. — С. 23701: 1–5. — Бібліогр.: 27 назв. — англ.

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Digital Library of Periodicals of National Academy of Sciences of Ukraine
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Резюме:On the basis of the perturbation formulas for a d¹ configuration ion in a tetragonal crystal field, the three optical absorption bands and electron paramagnetic resonance (EPR) parameters (g factors gi and hyperfine structure constants Ai for i = || and ⊥, respectively) of VO²⁺ in Na₃C₆H₅O₇·2H₂O single crystals were studied using the perturbation theory method. By simulating the calculated optical and EPR spectra to the observed values, local structure parameters and negative signs of the hyperfine structure constants Ai of the octahedral (VO₆)⁸⁻ cluster in {TSCD} single crystal can be obtained.