• 한국전기전자재료학회:학술대회논문집
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• 한국전기전자재료학회 2000년도 하계학술대회 논문집
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• pp.726-729
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• 2000

Though L $a_{1+x}$S $r_{2-x}$M $n_2$ $O_{7}$ n=2 R-P phases have been well known to have CMR effect, it was generally believed that n=1 phase was insulating. But recently monolayered perovskite $Ca_{2-x}$L $n_{x}$Mn $O_4$phase has been reported to show magnetoresistance. In this study, layered perovskite $Ca_{2-x}$L $n_{x}$Mn $O_4$ (x=0, 0.5, Ln=Pr, Nd, Sm, Gd) phases were synthesized by solid state reaction and their structures were refined by Rietveld method. The space groups of $Ca_2$Mn $O_4$, N $d_{0.5}$C $a_{1.5}$Mn $O_4$phases were refined as C2cb and Fmmm, respectively.y.ely.y.y.y.y.y.y.

• 한국암석학회:학술대회논문집
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• 한국암석회.한국광물학회 2009년도 공동학술발표회 논문집
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• pp.104-107
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• 2009

• 한국결정성장학회지
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• 제12권2호
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• pp.87-90
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• 2002

$LiCoO_{2}$ powders were synthesized at various temperatures using lithium hydroxide and cobalt hydroxide as precursors prepared by precipitation process and freeze-drying. In this study, the$LiCoO_{2}$ samples were synthesized via a solid state reaction with various LiOH concentration between 10 % and 30 % excess. And $LiCoO_{2}$powders were calcined at 600~$800^{\circ}C$ in a short time. Measurements of XRD and SEM were performed to characterize the properties of the prepared materials. The effect of amount of Li ions on the structural change in powder has been examined using the XRD analysis. For the not added excess of LiOH, CoOOH phase presented in the XRD pattern of $LiCoO_{2}$ due to loss of Li ions during firing. The morphology and particle size of the powders were examined using SEM. The obtained powders are high temperature-$LiCoO_{2}$HT-LiCoO$_{2}$) and homogeneous with the range of grain size in the order of hundreds of nanometers. The effects of variation of LiOH concentration on the structural change in powder were investigated using the Rietveld analysis. As an analysis result, c/a is constant by 4.99 on all occasions. Finally, the structure of HT-$LiCoO_{2}$ was simulated by the commercial software $Creius^{2}$(Molecular Simulations, Inc.) from the results of Rietveld analysis.

• 한국광물학회지
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• 제15권1호
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• pp.59-68
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• 2002

캐나다 퀘벡 주 오카지역에서 산출되는 네오비움 페롭스카이트(일명 라트라파이트, $Ca_2NbFe^{3+}O_6$)에 대하여 화학분석과 분말 X선 회절 데이터를 이용한 리트벨트 구조분석을 실시하였다. 라트라파이트는 $CaTiO_3-NaNbO_3-Ca_2NbFe^{3+}O_6$의 연속계열 고용체의 성분을 가지며, 화학분석 결과 평균$(Ca_{1.5}Na_{0.4})\;(Nb_{0.1}Ti_{0.6}Fe_{0.4})O_6$ 리트벨트 구조분석 결과 라트라파이트의 구조는 페롭스카이트($CaTiO_3$)의 결정구조와 유사하지만, Ti 이온이 Nb와 $Fe^{3+}$에 의해 치환되면서 상당히 뒤틀리고, $TiO_6$ 팔면체가 페롭스카이트에 비해 서로 기울어져 있는 모습을 보여준다 새롭게 결정된 라트라파이트의 공간군은 Pbnm, 단위포는 a=5.4474(4), b=5.5264(4), c=7.7519(5) ${\AA},\;V=233.4(3){\AA}^3$이다.

• 한국전기전자재료학회논문지
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• 제15권1호
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• pp.67-74
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• 2002

A phosphor for Plasma Display Panel, BaMgAl$_{10}$ O$_{17}$ :Eu$^{2+}$, showing a blue emission band at about 450nm was prepared by a solid-state reaction using BaCO$_3$, $Al_2$O$_3$, MgO, Eu$_2$O$_3$ as starting materials wish flux AlF$_3$. The study of the behaviour of Eu in BAM phosphor was carried out by the photoluminescence spectra and the Rietveld method with X-ray and neutron powder diffraction data to refine the structural parameters such as lattice constants, the valence state of Eu, the preferential site of Mg atom and the site fraction of each atom. The phenomenon of the concentration quenching was abound 2.25~2.3wt% of Eu due to a decrease in the critical distance for energy transfer of inter-atomic Eu. Through the combined Rietveld refinement, R-factor, R$_{wp}$, was 8.11%, and the occupancy of Eu and Mg was 0.0882 and 0.526 at critical concentration. The critical distance of Eu$^{2+}$ in BAM was 18.8$\AA$ at 2.25% Eu of the concentration quenching. Furthermore, c/a ratio was decreased to 3.0wt% and no more change was observed over that concentration. The maximum entropy electron density was found that the modeling of $\beta$-alumina structure in BaMgAl$_{10}$ O$_{17}$ :Eu$^{2+}$correct coincided showing Ba, Eu, O atoms of z= 1/4 mirror plane.e.ane.e.

• 한국광물학회지
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• 제22권1호
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• pp.63-72
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• 2009

개량된 MA법으로 합성된 $LiFe(PO_4)/C$에 대해 X-선 회절분석을 실시하여 리트벨트법에 의해 결정학적 연구를 수행하였다. 리트벨트 계산 결과 리트벨트 R 지수 값은 $R_p=8.14%,\;R_{wp}=11.1%,\;R_{exp}=9.09%,\;R_B=3.88%$, S (GofF, Goodness of fit) = 1.2으로 계산이 잘 이루어졌음을 알 수 있다. $LiFePO_4/C$는 공간군 Pnma를 가지며, 격자상수 값은 a = 10.3229(3)${\AA}$, b = 6.0052(2) ${\AA}$, c = 4.6939(1) ${\AA}$이고 체적값은 V = 290.98(1) ${\AA}^3$으로 기존 다른 합성법의 연구결과와 잘 일치한다. 분말 입자는 고순도를 가지고 나노 크기($65{\sim}90nm$)로 기존 MA법보다 상대적으로 미세하고 균질도가 향상되었다. 따라서 개량된 MA법은 상업용 리튬 2차 전지의 양극물질 생산을 위한 우수한 제조법으로 판단된다.

• 한국광물학회지
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• 제14권2호
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• pp.128-136
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• 2001

흘란다이트 터널 구조내의 A자리 양이온인 $Ba^{2+}$ 이온을 $K^{+ }$ 이온이 치환하면서 결정의 구조에 어떠한 변화가 있는지 알아보기 위해 K-Ba 전구간 완전고용체로 치환된 7개의 합성 흘란다이트형 광물($K_{2x}$ $Ba_{1}$ -x/$Cr_2$$Ti_{6}$ $O_{16}$ , x=0, 0.1, 0.3, 0.5, 0.7, 0.9, 1.0)에 대하여 X선 회절분석과 리트벨트 구조분석법을 실시하였다. 리트벨트 계산 결과, 구조의 정밀도를 나타내는 R 지수값을 보면$ R_{exp}$에 대한 $R_{wp}$ 값($R_{wp}$ /$R_{exp}$ )은 15.77%/20.90%~14.74%/l9.37%의 범위를 보여주며, $R_{B}$ 값은 6.45~8.97%, S (GofF)값은 1.45~l.63으로 각각 계산되었다. 합성 홀란다이트는 K-Ba 전구간에서 Ba의 함량에 관계없이 모두 공간군 14/m을 가지며, 단위포의 크기는 a=10.1194(2) ~ 10.0599(2)$\AA$, c=2.9572(6)~2.9512(7)$\AA$, V=302.75~298.66$\AA^{3}$의 범위를 보여주며, K 함량이 50% 이상에서는 금홍석이 부산물로 합성되었다. 그 결과 A자리의 Ba와 K의 치환관계에서는 비록 단위포의 크기에 일정한 변화를 보여주었으나 구조적 변이에 영향을 주기에는 충분치 않은 것으로 밝혀졌다. 따라서 정방정계에서 대칭성이 낮은 단사정계로의 구조적 변이는 A자리에 대한 K-Ba 치환보다는 다른 양이온의 치환이나 B자리의 치환 등 다른 요인에 의할 것으로 생각된다.다.

• 한국세라믹학회지
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• 제36권11호
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• pp.1139-1142
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• 1999

• 한국세라믹학회지
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• 제49권3호
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• pp.205-215
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• 2012

It has been studied the crystal and block structures of the hexagonal ferrites with M, W, Y and Z types prepared by various coprecipitation-oxidation method. The structures have been refined with a Rietveld analysis of the powder X-ray diffraction pattern with high precision ($R_{WP}$ <0.09, $R_I$ <0.03). The density difference between the S-blocks was proportioned to the cobalt contents in hexagonal ferrites, but that between the R or T-blocks was relatively small. Compared with the blocks and cation-oxygen polyhedra in BaM ($BaFe_{12}O_{19}$), those were bulky to the normal direction for the c-axis in $Co_2W$ ($BaCo_2Fe_{16}O_{27}$) and to the parallel direction for the c-axis in $Co_2Y$ ($Ba_2Co_2Fe_{12}O_{22}$) and $Co_2Z$ ($Ba_3Co_2Fe_{24}O_{41}$). The S-blocks of $Co_2W$, $Co_2Y$, and $Co_2Z$ were unstable and distorted. Because the T-block of $Co_2Z$ was unstable, the T-block was decomposed into the Ba-rich phase and $Co_2W$ at high temperatures above $1200^{\circ}C$. A standard powder X-ray diffraction pattern for $Co_2Z$ was proposed as well.

• Bulletin of the Korean Chemical Society
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• 제34권6호
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• pp.1679-1683
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• 2013

Intergrowth perovskite type complex oxides $La_{0.8}Ln_{0.2}Sr_2MnCrO_{7-{\delta}}$ (Ln=La, Nd, Gd, and Dy) have been synthesized by sol-gel method. Rietveld profile analysis shows that the phases crystallize with tetragonal unit cell in the space group I4/mmm. The unit cell parameters a and c decrease with decreasing effective ionic radius of the lanthanide ion. The magnetic studies suggest that the ferromagnetic interactions are dominant due to $Mn^{3+}$-O-$Mn^{4+}$ and $Mn^{3+}$-O-$Cr^{3+}$ double exchange interactions. Both Weiss constant (${\theta}$) and Curie temperature ($T_C$) increase with decreasing ionic radius of lanthanide ion. It was found that the transport mechanism is dominated by Mott's variable range hopping (VRH) model with an increase of Mott localization energy.