• 한국전기화학회:학술대회논문집
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• 2000.04a
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• pp.35-35
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• 2000

• Journal of the Korean Chemical Society
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• v.38 no.12
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• pp.928-931
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• 1994

• Journal of the Korean Magnetics Society
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• v.23 no.2
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• pp.43-48
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• 2013

The Jahn-Teller distortion of chalcogenide $Fe_{0.9}M_{0.1}Cr_2S_4$ (M=Co, Ni, Zn) have been investigated by M$\ddot{o}$ssbauer spectroscopy. The crystal structures of $Fe_{0.9}M_{0.1}Cr_2S_4$ (M=Co, Ni, Zn) are cubic spinel at room temperature. Magnetoresistance measurements indicate these system is conducting-semiconducting transistion around $T_C$. Below $T_C$, the asymmetric line broadening is observed and considered to be dynamic Jahn-Teller distortion. Isomer shift value of the samples at room temperature was about 0.5 mm/s, which means that charge state of Fe ions is ferrous in character. The Ni substitutions for Fe occur to increase the Jahn-Teller relaxation. CMR properties could be explained with magnetic polaron due to Jahn-Teller effect, which is different from both the double exchange interactions of manganite system and the triple exchange interactions of chalcogenide $Cu_xFe_{1-x}Cr_2S_4$.

• Journal of the Korean Magnetics Society
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• v.7 no.5
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• pp.225-231
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• 1997

Sulphur Spinel $Co_{0.95}Fe_{0.05}Cr_2S_4$ has been studied with Mossbauer Spectroscopy between 4.2 K and room temperature. The $Fe^{2+}$ ion in a tetrahedral site is the Jahn-Teller active and the dynamic Jahn-Teller distortion starts below the magnetic ordering temperature. The distortion cause a quadrupole shift to appear which increases with decreasing temperature. The magnetic hyperfine field has a maximum at 100 k and then decreases with decreasing temperature. The magnitude of the interaction ratio R between the electric quadrupole and magnetic dipole interaction increases from 0 near the magnetic ordering temperature to 5.4 at 4.2 K. The optimum values of 0, the polar angle of the magnetic hyperfine field with respect to the principle axis of the electric field gradient (EFG) remains zero and the asymmetry of the EFG n is about 0.25. The simulations of Mossbauer spectra coincidence with the experimental results.

• Journal of the Korean Magnetics Society
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• v.11 no.4
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• pp.151-156
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• 2001

Recently many studies on manganese oxides Ln$_{1-x}$A$_{x}$MnO$_3$(Ln=La, Pr, Nd lanthannide; A=Ca, Sr, Ba, Pb +2 ions) reported CMR properties. CMR have been also found in chalcogenide spinels. We have investigated that Ni ion substitutions for Fe ion have effects on CMR properties in chacogenide spinels Ni$_{x}$Fe$_{1-x}$Cr$_2$S$_4$. It was found that with increasing Ni concentration Jahn-Teller distortion was strengthened and Curie temperature T$_{c}$ was increased. CMR properties could be explained with Jahnl-Teller effect, half-metallic electronic structure, and the alignment of magnetic domain due to the strong magnetic field, which is different in that double exchange interactions dominate CMR properties in manganese oxides.

• Bulletin of the Korean Chemical Society
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• v.35 no.5
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• pp.1511-1515
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• 2014

The multiconfiguration second-order perturbation theory (CASPT2) and complete active space self-consistent field (CASSCF) methods were employed to calculate the geometries and energy levels for the low-lying electronic states of 1,3,5-$C_6H_3Cl{_3}^+$ ion. The CASPT2 values for the 1,3,5-$C_6H_3Cl{_3}^+$ ion were in reasonable agreement with the available experimental values. The current calculations augmented previous theoretical investigations on the ground state and assigned the low-lying excited electronic states of the 1,3,5-$C_6H_3Cl{_3}^+$ ion. The Jahn-Teller distortion in the excited electronic state for the 1,3,5-$C_6H_3Cl{_3}^+$ ion were reported for the first time.

• Bulletin of the Korean Chemical Society
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• v.25 no.6
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• pp.921-923
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• 2004

• Journal of the Korean Crystal Growth and Crystal Technology
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• v.9 no.2
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• pp.245-250
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• 1999

The effect of cation substitution on the inonic conductivity was studied in $(Li_{0.5}La_{0.5})_{1-y}Sr_yTi_{1-x}Mn_xO_3$ system. In case of Sr substitution, the ionic conductivity abrubtly decreased over y=0.05. This may be caused by the decrease of lithium contents which contribute to lithium inonic conductivity. Jahn-Teller distortion as well as lattice parameter variation influenced the inonic conductivity in case of Mn substitution. A and B-site cations effects on the conductivities were found to be independent, and the ionic conductivity as high as $2.8{\times}10^{-2}$S/cm was obtained in x=0.0006 and y=0.05.

• Journal of the Korean Magnetics Society
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• v.9 no.3
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• pp.131-135
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• 1999

The electronic structures and properties of layered perovskite $LaSrMnO_4$ and $SR^2MnO_4$ have been determined using the local-density full potential Imearized augmented plane wave method. The total energy calculations show that the antiterromagnetic state has lower energy than the ferromagnetic state in $LaSrMnO_4$. The jahn-Teller distortion of Mn-O octahedron produces the energy gap and the $3z^2-r^2$ orbital ordering, which stabilizes 2 dimensional antiferromagnetis state.

• Bulletin of the Korean Chemical Society
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• v.20 no.6
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• pp.657-662
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• 1999

The variation of Jahn-Teller(J-T) distortion imposed on various metallo- tetraphenylporphyrins(MTPPS;M=ZnⅡ,PdⅡ,PtⅡ,and RhⅢ) has been investigated by time-resolved resonance Raman spectroscopy. B1g and B2g modes of the triplet(π,π*) states for the heavy-metal porphyrins exhibit the enhancement of their intensities compared with those of 3ZnⅢTPP, while the enhancement of phenyl internal mode is reduced. These results suggest that the J-T distortion becomes manifest as the metal size increases, and consequently the porphyrin-to-phenyl ring charge transfer in the excited triplet state is inhibited.