• Title/Summary/Keyword: cation substitution

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Control of $NaAlSiO_4:Eu^{2+}$ photoluminescence properties by charge-compensated aliovalent element substitutions

  • Kim, Jihae;Kato, Hideki;Kakihana, Masato
    • Journal of Information Display
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    • v.13 no.3
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    • pp.97-100
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    • 2012
  • We have conducted two kinds of the so-called charge-compensated aliovalent element substitutions to control the photoluminescence properties of $NaAlSiO_4:Eu^{2+}$ with a special focus on the enhancement of the excitation intensity at 400 nm. The aliovalent element substitutions include cation-cation and cation-anion co-substitutions according to the general formulas $Na_{1-x}M_xAl_{1+x}Si_{1-x}O_4:Eu^{2+}$ and $Na_{1-x}M_xAlSiO_{4-x}N_x:Eu^{2+}$ (M = $Mg^{2+}$, $Ca^{2+}$, and $Sr^{2+}$), respectively. The increase in the relative excitation intensity at 400 nm has been achieved in both types of the co-substitutions. Thus, the present research has demonstrated the effectiveness of the charge-compensated element substitution.

Comparative Crystal Chemistry of Exchanged by Cs-, Cd-, Pb-, and Sr-synthetic Mordenite Using High Resolution X-ray Powder Diffraction (고분해능 X-선 분말 회절을 이용한 Cs-, Cd-, Pb-, Sr-으로 치환된 합성 모데나이트의 격자상수 비교 연구)

  • Lee, Soojin;Lee, Hyunseung;Seoung, Donghoon;Kim, Pyosang;Kim, Hyeonsu;Lee, Yongmoon
    • Korean Journal of Mineralogy and Petrology
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    • v.35 no.3
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    • pp.345-353
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    • 2022
  • This study aimed to fundamentally understand changes of cell parameters of cation-exchanged mordenites using high resolution X-ray powder diffraction for studies that immobilization of various heavy metal cation using synthesis mordenite (Na6.6Al6.6Si41.4O96·20.4H2O, Na-MOR). As a results of measurement by Thermogravimetric analysis (TGA), it was confirmed that 19.4, 20.4 water molecules per unit cell were present in monovalent-cation substituted MOR (Cs-MOR, Na-MOR), and 21, 23.1, 23.2 water molecules per unit cell were present in divalent-cation substituted MOR (Pb-MOR, Sr-MOR, Cd-MOR). The space group of all the samples were identified as Cmcm belonging to the orthorhombic crystal system. Compared to Na-MOR, starting material, relative peak intensity of (110) and (200) is significantly changed after cation substitution whereas peak position is almost similar. Also, (220) peak that was not found in Na-MOR was clearly observed in Pb-, Cd- and Sr-exchanged MOR. Thus, it was estimated that changes of atomic distribution usually occurred on ab-plane while changes of cell parameters were little. Detailed changes in the cell parameters of cation-exchanged mordenites were derived from whole profile fitting method using the GSAS suite program. Changes in the axial lengths and unit cell volume of cation substitution showed different relationship depending on ionic radius and charge number. In case of monovalent-cation substituted MOR, the length of a-axis increases whereas the length of b- and c-axis decrease by absorbed cation radius. In the case of divalent-cation exchanged MOR, the length of a-axis usually decreases while the length of b- and c-axis increases by cation radius. It was confirmed that unit cell volume of monovalent and divalent cation substituted MORs had an independent tendency by cation radius.

Spectroscopic Investigation of cis-2,4-Difluorophenol Cation by Mass-analyzed Threshold Ionization Spectroscopy

  • Shivatare, Vidya;Tzeng, Wen Bih
    • Bulletin of the Korean Chemical Society
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    • v.35 no.3
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    • pp.815-820
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    • 2014
  • We applied the two-color resonant two-photon ionization and mass-analyzed threshold ionization techniques to record the vibronic and cation spectra of 2,4-difluorophenol. As supported by our theoretical calculations, only the cis form of 2,4-difluorophenol involves in the two-photon photoexcitation and pulsed field ionization processes. The band origin of the $S_1{\leftarrow}S_0$ electronic transition of cis-2,4-difluorophenol appears at 35 647 ${\pm}2cm^{-1}$ and the adiabatic ionization energy is determined to be 70 $030{\pm}5cm^{-1}$, respectively. Most of the observed active vibrations in the electronically excited $S_1$ and cationic ground $D_0$ states mainly involve in-plane ring deformation vibrations. Comparing these data of cis-2,4-difluorophenol with those of phenol, cis-2-fluorophenol, and 4-fluorophenol, we found that there is an additivity rule associated with the energy shift resulting from the additional fluorine substitution.

Theoretical Study of Isotope and Cation Binding Effects on the Hydration of BDNA

  • Kang, Young-Kee;Jhon, Mu-Shik
    • Bulletin of the Korean Chemical Society
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    • v.2 no.1
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    • pp.24-28
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    • 1981
  • Theoretical studies of the sodium cation binding and the isotope hydration effects on the static model compound B-DNA have been qualitatively elucidated by using empirical potential energy functions. In the first place, the sodium cations bound to phosphate anions and their hydration scheme have been optimized and have given a reasonable agreement with other theoretical results and experimental studies. In the second stage, the isotope effect on the hydration through the substitution of $D_2O\;for\;H_2O$ has been carried out by the same procedure. The stabilization of B-DNA has been explained and compared in terms of the sodium cation binding to phosphate anions and its hydration in both cases of $H_2O\;and\;D_2O$.

Structural and Magnetic Properties of Dilute Spinel Ferrites: Neutron Diffractometry and Magnetometry Investigations

  • Mamiya, H.;Terada, N.;Kitazawa, H.;Hoshikawa, A.;Ishigaki, T.
    • Journal of Magnetics
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    • v.16 no.2
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    • pp.134-139
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    • 2011
  • Magnetic properties of highly zinc-substituted manganese ferrites are discussed on the basis of cation distribution. High throughput neutron powder diffractometry indicates that the prepared samples possess a nearly normal spinel structure, where the substitution of nonmagnetic zinc ions mainly causes the dilution of magnetic ions in the A-sublattice and consequently affects bond-randomness in the B-sublattice. On the other hand, the estimated occupancy of manganese ions in the B site indicates that random anisotropy effects due to local Jahn-Teller distortions gradually weaken with the substitution. Bulk magnetometry indicates that the substitution smears the transition from a paramagnetic phase to a soft-magnetic phase. Furthermore, at lower temperatures, such a soft-magnetic phase is destabilized and a magnetic glassy state appears. These features of the magnetic properties of dilute spinel ferrites are discussed from the viewpoint of the above-mentioned various types of disorders.

Cation Substitution Induced Enhanced Photoluminescence Properties of Gd2(1-x-y)Y2xMo4O15:2yEu3+ Phosphors for Indoor Lighting

  • Du, Peng;Yu, Jae Su
    • Applied Science and Convergence Technology
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    • v.27 no.3
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    • pp.52-55
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    • 2018
  • We reported a new method to enhance the photoluminescence (PL) properties of $Eu^{3+}$ ions doped $Gd_2Mo_4O_{15}$ phosphors via cation substitution. With the aid of conventional sol-gel method, a series of $Eu^{3+}$ ions doped $Gd_{2(1-x)}Y_{2x}Mo_4O_{15}$ phosphors were prepared. The prepared samples emitted red light when excited at 393 nm. Moreover, when part of the $Gd^{3+}$ ions was substituted by the $Y^{3+}$ ions, the PL emission intensity of the studied samples was enhanced and the optimal doping concentration for $Y^{3+}$ ions was 30 mol%. The calculated CIE coordinate (0.663,0.337) was situated in the red region. Furthermore, the thermal quenching behaviors of the synthesized $Eu^{3+}$ ions doped $Gd_{2(1-x)}Y_{2x}Mo_4O_{15}$ phosphors were studied. At last, we also packaged a red-emitting light-emitting diode device by integrating the obtained phosphors and a near-ultraviolet chip to verify the applications of the $Eu^{3+}$ ions doped $Gd_{2(1-x)}Y_{2x}Mo_4O_{15}$ phosphors for indoor lighting.

Theoretical Studies on Electrophilic Substitution of Five-membered Heteroaromatic Compounds with Isopropyl Cation (5각-이종원자 방향족 고리화합물과 이소프로필 양이온간의 친전자 치환반응에 관한 이론적 연구 (1))

  • Lee, Ik Choon;Kim, Chang Gon;Lee, Bon Su
    • Journal of the Korean Chemical Society
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    • v.34 no.3
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    • pp.248-254
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    • 1990
  • Theoretical studies on the electrophilic substitution reactions of five-membered heteroaromatic compounds, furan, pyrrole and thiophene, with isopropyl cation were carried out using the MNDO method. The results indicated that site selectivities of ${\alpha},{\beta}$ and hetero-atoms are not controlled by electrostatic interactions but are determined mainly by charge trasfer stabilization between the HOMO of heteroaromatics and the LUMO of the electrophile. The reactivity order for ${\alpha}\;and\;{\beta}$ positions was pyrrole > furan > thiophene, in agreement with the solution-phase as well as the gas-phase experimental results.

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Crystallographic and Magnetic Properties of Nano-sized Nickel Substituted Cobalt Ferrites Synthesized by the Sol-gel Method

  • Choi, Won-Ok;Lee, Jae-Gwang;Kang, Byung-Sub;Chae, Kwang Pyo
    • Journal of Magnetics
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    • v.19 no.1
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    • pp.59-63
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    • 2014
  • Nano-sized nickel substituted cobalt ferrite powders, $Ni_xCo_{1-x}Fe_2O_4$ ($0.0{\leq}x{\leq}1.0$), were fabricated by the sol-gel method, and their crystallographic and magnetic properties were studied. All the ferrite powders showed a single spinel structure, and behaved ferrimagnetically. When the nickel substitution was increased, the lattice constants and the sizes of particles of the ferrite powders decreased. The M$\ddot{o}$ssbauer absorption spectra of $Ni_xCo_{1-x}Fe_2O_4$ ferrite powders could be fitted with two six-line subspectra, which were assigned to a tetrahedral A-site and octahedral B-sites of a typical spinel crystal structure. The increase in values of the magnetic hyperfine fields indicated that the superexchange interaction was stronger, with the increased nickel concentration in $Ni_xCo_{1-x}Fe_2O_4$. This could be explained using the cation distribution, which can be written as, $(Co_{0.28-0.28x}Fe_{0.72+0.28x})[Ni_xCo_{0.72-0.72x}Fe_{1.28-0.28x}]O_4$. The two values of the saturation magnetization and the coercivity decreased, as the rate of nickel substitution was increased. These decreases could be explained using the cation distribution, the magnetic moment, and the magneto crystalline anisotropy constant of the substituted ions.

Thermal and Mineralogical Characterization of Ca-montmorillonite from Gampo area : Comparison between Jugjeon and Yongdongri deposit (감포지역(甘浦地域) Ca-몬모릴로나이트의 광물학적(鑛物學的) 및 열적특성(熱的特性) : 죽전(竹田) 및 용동리지역(龍洞里地域) 광상(鑛床) 비교연구(比較硏究))

  • Moon, Hi-Soo;Ahn, Jae Yeong;Choi, Sun Kyung;Kim, Moon Young;Morgan, D.J.
    • Economic and Environmental Geology
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    • v.22 no.3
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    • pp.207-219
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    • 1989
  • Eight under 2 micron size fractions of the montmorillonite from Jugjeonri area, Gyeongsanbug-do, were studied and then this result has been compared with data from Yongdongri area. Montmorillonites occurring at the same stratigraphic horizon in each area show limited variation in chemical composition, but shows some degree of differences in exchangeable cation compositions and total layer charges of montmorillonites from Jugjeonri to Yongdongri area. In general, samples from Jugjeonri show higher amount of exchangeable Na and layer charge due to relatively higher substitution of Mg for Al in octahedral sites than those from Yongdongri area. But Their dehydroxylation endothermic peaks of the samples from both areas are abnormal type with a small range of variation of peak temperature. This variation seems to reflect tetrahedral substitution of AI for Si for samples from Yongdongri whereas samples from Jugjeonri do not show shuch a tendency. However, samples from Jugjeonri proved to be relatively higher dehydroxylation peak temperatures than those of the other. DSC data for sample from Jugjeonri also show that divalent-cation saturated montmorillonite have relatively a higher endothermic heat capacities than monovalent-cation saturated one as shown in previous work. Two different morphologies of montmorillonites, honeycomb structure and closely packed intergrowth, by SEM were observed in samples from both areas but the later one is common. The scalloped type is relatively abundant in the sample from Yongdongri than the other. The dominant habit by TEM are irregularly shaped foliated aggregates and platy shaped particles. In general, foliated aggregates which are easy to disperse are relatively abundant in the samples from Jugjeon compared with those from Yongdongri area.

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