• Bulletin of the Korean Chemical Society
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• 제27권9호
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• pp.1297-1304
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• 2006

A systematic study of the structure, energetics and spectral characteristics of substituted aminoketenes $R(NH_2)$C=C=O (R = H, $CH_3$, $NH_2$, OH, $OCH_3$, CH=$CH_2$, C$\equiv$CH, CN, CHO, NO, $NO_2$) which are highly reactive and transient intermediates in synthesis has been conducted by ab initio calculations at the MP2/6- 31G*//MP2/6-31G* level. Twenty four stable isomers of the eleven substituted aminoketenes having dihedral angles $\phi NH_2\sim120{^{\circ}}$ and $60^{\circ}$ have been identified and their optimized geometries and energies obtained. Electrostatic and steric effects on the molecular geometries have been analyzed. While the $\pi$-acceptor groups lead to planar conformations, the electron-donor groups give rise to non-planar conformations. Isodesmic substituent stabilization energies relative to alkenes have been calculated and correlation with group electronegativities established. Role of induction effect by the substituent groups and resonance effects in charge distribution in the molecules has been analyzed. An analysis of the asymmetric stretching frequencies and intensities of the C=C=O group shows that affect of non-$\pi$ acceptor substituents on the frequency is determined by the field effect (F) and resonance effect (R) parameters, the calculated intensities I (km/mol.) are correlated to group electronegativities $x$ of the substituents by the relationship I = 640.2–100.1 $x$ (r = 0.92). The $\pi$-acceptor substituents increase the intensity which may be explained in terms of their delocalizing effect on the negative charge at the $C_{\beta}$ atom.

• 한국진공학회:학술대회논문집
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• 한국진공학회 2016년도 제50회 동계 정기학술대회 초록집
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• pp.304.2-304.2
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• 2016

Hafnium oxide-aluminum oxide (HfO2-Al2O3) dielectric films have been fabricated by Pulsed Laser Deposition (PLD), and their properties are studied in comparison with HfO2 films. As a gate dielectric of the TFT, in spite of its high dielectric constant, HfO2 has a small energy band gap and microcrystalline structure with rough surface characteristics. When fabricated by the device, it has the drawback of generating a high leakage current. In this study, the HfAlO films was obtained by Pulsed Laser Deposition with HfO2-Al2O3 target(chemical composition of (HfO2)86wt%(Al2O3)14wt%). The characteristics of the thin Film have been investigated by x-ray diffraction (XRD), atomic force microscopy (AFM) and spectroscopic ellipsometer (SE) analyses. The X-ray diffraction studies confirmed that the HfAlO has amorphous structure. The RMS value can be compared to the surface roughness via AFM analysis, it showed HfAlO thin Film has more lower properties than HfO2. The energy band gap (Eg) deduced by spectroscopic ellipsometer was increased. HfAlO films was expected to improved the interface quality between channel and gate insulator. Apply to an oxide thin Film Transistors, HfAlO may help improve the properties of device.

• 한국환경농학회지
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• 제18권4호
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• pp.378-383
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• 1999

본 연구는 수피 부산물 비료의 돈분 부산물 비료의 부숙단계별 시료의 유기물 분획의 함량 변화, ${\Delta}log$ K값과 RF값 등의 분광학적 특성 변화, 원형여지 chromatograp의 변화를 측정하여, 부숙도의 판정 기준 설정을 위한 기초 자료로 활용하는데 그 목적이 있다. 그 결과를 요약하면 다음과 같다. 수피와 돈분 부산물빌 중 HA-C와 FA-C의 함량은 대체로 부숙이 진행됨에 따라 감소하는 경향이었고, HA-C/FA-C 비는 증가하였다. 수피와 돈분 부산물 비료의 ${\Delta}log$ K값은 부숙이 진행됨에 따라 감소하였으며, RF값은 증가하였다. 생수피의 부식산 형태는 $R_p$ 형태였으나, B형태를 거쳐 120일경과 후 A형태로 변화하여 거의 완숙상태에 도달하였으며, 돈분 부산물 비료의 경우 40일경과 후에도 B형태로 나타나 유기물질의 부숙이 진행중인 것으로 판단되었다. 수피부산물 비료의 원형여지 chromatograph는 120일경과 후에 규칙적인 톱니 모양을 하고 있어 완숙단계에 이른 것으로 판단할 수 있었으나, 돈분 부산물의 경우는 40일이 경과한 후에도 부분적으로 불규칙적인 모양을 하고 있어 부숙이 진행되고 있는 상태인 것으로 판단할 수 있었다.

• 한국물환경학회지
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• 제25권4호
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• pp.589-596
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• 2009

The spectroscopic characteristics and chemical oxygen demand (COD) oxidation efficiencies were investigated for dissolved organic matters (DOM) from diverse sources, which may indirectly affect the concentrations and the quality of DOM found in watersheds. The DOM investigated for this study showed a wide range of the percent distributions of refractory organic matter (R-OM) from 8 to 100%. Relatively high R-OM distributions were observed for the DOM with the source of head water, sediments, paddy soils, field soils, and treated sewage whereas the DOM from livestock waste, reed, weeds, algae, and attached algae exhibited lower R-OM percent distributions. The percent distribution of R-OM had positive correlations with specific UV absorbance (SUVA) and humidification indices (HIX) of DOM. The investigated DOM was classified into four different source groups (i.e., biota, vegetables, soils, sediments) by comparing the synchronous fluorescence spectra. The DOM group from biota source was characterized by a prominent presence of protein-like fluorescence (PLF) whereas fulvic-like fluorescence (FLF) was additionally observed for vegetable-source DOM. FLF became significant for the DOM from both soils and sediments although no PLF was found for soil-derived DOM. A range of COD oxidation efficiency was observed for the various DOM, ranging from 36 to 94% and from 65 to 125% for $COD_{Mn}$ and $COD_{Cr}$, respectively. The results indicate that $COD_{Cr}$ reflects the higher OM concentration than $COD_{Mn}$. However, 95% confidence intervals of the COD oxidation efficiencies were similar for the two types of COD, suggesting that $COD_{Cr}$ may not be the superior OM index to $COD_{Mn}$ in terms of the variability of the oxidation efficiency. No significant correlations were obtained between COD oxidation efficiencies and the spectroscopic characteristics of DOM for this study.

• 한국광물학회지
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• 제21권4호
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• pp.355-364
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• 2008

현재 에메랄드의 중요한 산지로 자리 잡아가고 있는 Itabira 지역 에메랄드의 분광학적 특성을 연구하기 위하여 에메랄드를 C-축에 수직, 수평인 방향으로 각각 절단하였으며, $H_2O$ 관련 범위의 좀더 세부적인 피크 관찰을 위하여 KBr로 압축한 pellet시료를 만들어 적외선 분광분석(FTIR) 실험을 수행하였다. $H_2O$ 관련 범위에서 $5,271\;cm^{-1}$, $1,638\;cm^{-1}$ 피크가 나타나는 것으로 보아 본 시료는 Type-II에 해당함을 관찰할 수 있었으며, $H_2O-Na-H_2O$ 배열 형태를 가지는 Type-IIa에 해당하는 피크가 아주 강하게 나타나고 있다. $H_2O$ 관련 범위를 제외한 특정 범위에서는 $CO_2$, Cl 피크 등이 관찰되었으며, 적외선 분광분석 법을 이용하여 타입의 분류뿐만 아니라 상대적인 피크 강도 비교를 통하여 $Na_2O$ 함량 또한 예측 가능한 것으로 사료된다.

• Bulletin of the Korean Chemical Society
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• 제24권8호
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• pp.1075-1080
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• 2003

We have investigated femtosecond coherent vibrational motions of Zn(II)-5,15-diphenylporphyrin in toluene using chirp-controlled ultrashort pulses. The oscillatory features superimposed on the temporal profiles of the pump-probe transient absorption signal are affected by the chirping and energy of excitation pulses. Using chirp- and excitation energy-controlled femtosecond pulses, we are able to obtain information on the structural changes between the electronic ground and excited states based on a comparative analysis of the Fouriertransformed frequency-domain spectra retrieved from the oscillatory components with the ground state resonance Raman spectra and normal mode calculations.

• 한국해양공학회:학술대회논문집
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• 한국해양공학회 2001년도 추계학술대회 논문집
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• pp.292-300
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• 2001

The paper describes spectroscopic characteristics of plasma induces in the pulsed YAG laser welding of alloys containing a large amount of volatile elements. The authors have conducted the spectroscopic analyses of laser induced Al-Mg alloys plasma in the air and argon atmosphere. In the air environment, the identified spectra were atomic lines of Al, Mg, Cr, Mn, Cu, Fe and Zn, and singly ionized Mg lines, as well as the intense molecular spectra of A10 and Mg0 formed by chemical reactions of evaporated Al and Mg atoms from the pool surface with oxygen in the air. In argon atmosphere, Mg0 and AI0 spectra vanished, but AIH spectrum was detected. The hydrogen source was presumably hydrogen dissolved in the base metals, water absorbed on the surface oxide layer, or $H_2$ and $H_2O$ in the shielding gas. The resonant 1ines of Al and Mg were strongly self-absorbed, in particular, self-absorption of the Mg 1ine was predominant. These results show that the laser induced plasma was made of metal1ic vapor with relatively low temperature and high density.

• Journal of Astronomy and Space Sciences
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• 제35권1호
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• pp.7-18
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• 2018

We have investigated the intensities and full width at half maximum (FWHM) of the high dispersion spectroscopic N III emission lines of AG Peg, observed with the Hamilton Echelle Spectrograph (HES) in three different epochs at Mt. Hamilton's Lick Observatory. The earlier theoretical Bowen line study assumed the continuum fluorescence effect, presenting a large discrepancy with the present data. Hence, we analyzed the observed N III lines assuming line fluorescence as the only suitable source: (1) The O III and N III resonance line profiles near ${\lambda}$ 374 were decomposed, using the Gaussian function, and the contributions from various O III line components were determined. (2) Based on the theoretical resonant N III intensities, the expected N III Bowen intensities were obtained to fit the observed values. Our study shows that the incoming line photon number ratio must be considered to balance at each N III Bowen line level in the ultraviolet radiation according to the observed lines in the optical zone. We also found that the average FWHM of the N III Bowen lines was about $5km{\cdot}s^{-1}$ greater than that of the O III Bowen lines, perhaps due to the inherently different kinematic characteristics of their emission zones.

• 한국결정성장학회지
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• 제25권5호
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• pp.188-192
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• 2015

러시아 상트페테르부르크에 소재한 뉴 테크놀로지 다이아몬드(NDT)에서 생산된 보석용 합성 다이아몬드의 보석학적, 분광학적 특성을 조사하였다. 컬러(무색은 극미량의 붕소를 함유하고 있고 블루는 미량의 붕소를 함유하고 있음)와 클래리티 등급은 천연 다이아몬드와 비교할 때 손색이 없었다. NDT 합성 다이아몬드는 자외선 단파에서 블루, 오렌지의 형광과 인광 반응이 관찰되었다. PL 분석에서 H3 센터와 NV 센터가 발견되었으며, H3 센터의 intensity는 천연 다이아몬드와 비교할 때 매우 약하게 존재하였다. NDT에서 생산된 합성 다이아몬드의 보석학적, 분광학적 특징들을 통해 천연 다이아몬드와 구분할 수 있다.

• Bulletin of the Korean Chemical Society
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• 제24권5호
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• pp.579-582
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• 2003

Norfloxacin, that inhibits the action of topoisomerase Ⅱ, binds to wide variety of DNA. The binding mode of this drug to double- and super-coiled DNA (ds- and scDNA) is compared in this study by various spectroscopic methods, including absorption, fluorescence, and circular dichroism(CD) spectroscopy. Hypochromism in the absorption band, negative and positive induced CD bands (respectively in 240-260 nm and 270-300 nm region) are apparent for the norfloxacin that bound to both the dsDNA and scDNA. A decrease in fluorescence is also noticed in the presence of both DNAs. Since the spectroscopic characteristics are the same for both complexes, it is imperative that the binding mode of the norfloxacin is similar in ds- and scDNA. In the presence of $Mg^{2+}$, which is a cofactor in the topoisomerase Ⅱ action, the fluorescence intensity of the scDNA-norfloxacin complex increased and the resulting fluorescence intensity and shape was identical to that in the absence of scDNA. Therefore, the addition of an excess amount of $Mg^{2+}$ may result in the extrusion of norfloxacin from scDNA.