• 제목/요약/키워드: Quantum systems

검색결과 332건 처리시간 0.027초

Theoretical Study of Thiazole Adsorption on the (6,0) zigzag Single-Walled Boron Nitride Nanotube

  • Moradi, Ali Varasteh;Peyghan, Ali Ahmadi;Hashemian, Saeede;Baei, Mohammad T.
    • Bulletin of the Korean Chemical Society
    • /
    • 제33권10호
    • /
    • pp.3285-3292
    • /
    • 2012
  • The interaction of thiazole drug with (6,0) zigzag single-walled boron nitride nanotube of finite length in gas and solvent phases was studied by means of density functional theory (DFT) calculations. In both phases, the binding energy is negative and presenting characterizes an exothermic process. Also, the binding energy in solvent phase is more than that the gas phase. Binding energy corresponding to adsorption of thiazole on the BNNT model in the gas and solvent phases was calculated to be -0.34 and -0.56 eV, and about 0.04 and 0.06 electrons is transferred from the thiazole to the nanotube in the phases. The significantly changes in binding energies and energy gap values by the thiazole adsorption, shows the high sensitivity of the electronic properties of BNNT towards the adsorption of the thiazole molecule. Frontier molecular orbital theory (FMO) and structural analyses show that the low energy level of LUMO, electron density, and length of the surrounding bonds of adsorbing atoms help to the thiazole adsorption on the nanotube. Decrease in global hardness, energy gap and ionization potential is due to the adsorption of the thiazole, and consequently, in the both phases, stability of the thiazole-attached (6,0) BNNT model is decreased and its reactivity increased. Presence of polar solvent increases the electron donor of the thiazole and the electrophilicity of the complex. This study may provide new insight to the development of functionalized boron nitride nanotubes as drug delivery systems for virtual applications.

디지털 래디오그라피의 신호 및 잡음 특성에 대한 방사선 영향에 관한 연구 (Investigation of Radiation Effects on the Signal and Noise Characteristics in Digital Radiography)

  • 김호경;조민국
    • 대한의용생체공학회:의공학회지
    • /
    • 제28권6호
    • /
    • pp.756-767
    • /
    • 2007
  • For the combination of phosphor screens having various thicknesses and a photodiode array manufactured by complementary metal-oxide-semiconductor (CMOS) process, we report the observation of image-quality degradation under the irradiation of 45-kVp spectrum x rays. The image quality was assessed in terms of dark pixel signal, dynamic range, modulation-transfer function (MTF), noise-power spectrum (NPS), and detective quantum efficiency (DQE). For the accumulation of the absorbed dose, the radiation-induced increase both in dark signal and noise resulted in the gradual reduction in dynamic range. While the MTF was only slightly affected by the total ionizing dose, the noise power in the case of $Min-R^{TM}$ screen, which is the thinnest one among the considered screens in this study, became larger as the total dose was increased. This is caused by incomplete correction of the dark current fixed-pattern noise. In addition, the increase tendency in NPS was independent of the spatial frequency. For the cascaded model analysis, the additional noise source is from direct absorption of x-ray photons. The change in NPS with respect to the total dose degrades the DQE. However, with carefully updated and applied correction, we can overcome the detrimental effects of increased dark current on NPS and DQE. This study gives an initial motivation that the periodic monitoring of the image-quality degradation is an important issue for the long-term and healthy use of digital x-ray imaging detectors.

Recent Advances in Di-$\pi$-methane Processes. Novel Reactions of 1,4-Unsaturated Compounds Promoted by Triplet Sensitization and Photoelectron Transfer

  • Armesto, Diego;Ortiz, Maria J.;Agarrabeitia, Antonia R.
    • Journal of Photoscience
    • /
    • 제10권1호
    • /
    • pp.9-20
    • /
    • 2003
  • Recent studies on the photoreactivity of l,4-unsaturated systems have changed some ideas that were firmly established in this area of research for many years. Thus, we have described the first examples of 2-aza-di-$\pi$-methane (2-ADPM) rearrangements promoted by triplet-sensitization and by single electron transfer (SET) using electron-acceptor sensitizers. These reactions afford N-vinylaziridine and cyclopropylimine photoproducts in the first examples of di-$\pi$-methane processes that yield three-membered ring heterocycles. l-Aza-1,4-dienes also undergo SET-promoted l-aza-di-$\pi$-methane (l-ADPM) rearrangements via radical-cation intermediates using electron acceptor sensitizers. In some cases, alternative cyclizations yielding different carbocycles and heterocycles have been observed. The l-ADPM and di-$\pi$-methane (DPM) reactions also occur via radical-anion intermediates on irradiation using electron donor sensitizers. On the other hand, the photoreactivity reported for $\beta$,${\gamma}$-unsaturated aldehydes for many years was decarbonylation to the corresponding alkenes. However, our studies demonstrate that these compounds undergo the oxa-di-$\pi$-methane (ODPM) rearrangement with high chemical and quantum efficiency. A comparison of the photochemical reactivity of $\beta$,${\gamma}$-unsaturated aldehydes and corresponding methyl ketones has shown that the ketones do not undergo the ODPM rearrangement while the corresponding aldehydes are reactive by this pathway. Monosubstituted $\beta$,${\gamma}$-unsaturated aldehydes at C-2 undergo the ODPM rearrangement yielding the corresponding cyclopropane carbaldehydes diastereoselectively. Finally, we have described the first examples of reactions, similar to the well know Norrish Type I process, which take place in the triplet excited state of $\beta$,${\gamma}$-unsaturated carbonyl compounds by excitation of the C-C double bond instead of the carbonyl group.

  • PDF

형광광도법에 의한 수용액중 수용성 폴리파라시클로판류의 결합부위의 극성 측정 (Quantitative Estimation of Binding Site Polarities of Water-Soluble Polyparacyclophanes in Aqueous Solution by Spectrofluorometry)

  • 전인구
    • Journal of Pharmaceutical Investigation
    • /
    • 제21권3호
    • /
    • pp.133-141
    • /
    • 1991
  • The fluorescence characteristics of l-anilinonaphthalene-8-sulfonate (ANS) and 2-p-toluidinylnaphthalene-6-sulfonate (TNS) made the dyes useful probes for the determination of the polarity at the binding sites of several water-soluble polyparacyclophanes. Polyparacyclophanes used were 1,6,20,25-tetraaza[ 6.1.6.1]paracyclophane (CPM 44), 1,7,21,27 -tetraaza[7.1.7.1]paracyclophane (CPM 55). 1,7,21,27 -tetraaza-14,34-dioxa[7.1.7.1]paracyclophane (CPE 55) and 1,8,22,29-tetraaza-15,36-dioxa[8.1.8.1] paracyclophane (CPE 66). The fluorescence quantum yield, emission maximum, and half bandwidth of ANS or TNS obtained in a variety of solvent systems were plotted as a function of four kinds of empirical solvent polarity scales such as dielectric constant (D), (D-l)/(2D+1). Y and Z values. It was found that the Z-value-emission maximum $(\overline}V_F,\;cm^{-1})$ profile showed the most reliable linearity. ANS and TNS interacted with CPM 44, CPM 55, CPE 55. CPE 66. ${\alpha}-cyclodextrin$ (CyD) and ${\beta}-CyD$ in the aqueous solution, and from the emission maxima the polarities (Z-value) of their binding sites were calculated to be 92.65, 87.50, 93.35, 84.52, 94.36, and 90.48 for ANS, respectively. and 91.07, 89.68, 85.44, 86.74 and 87.6 for TNS except for ${\alpha}-CyD$, respectively.

  • PDF

금융규제와 R&D 투자 - 자기자본, 금리 및 업무영역 규제를 중심으로 - (Financial Regulation and R&D Investment)

  • 김병우
    • 기술혁신학회지
    • /
    • 제12권3호
    • /
    • pp.582-613
    • /
    • 2009
  • 본 연구의 실증분석은 다양한 금융규제가 기술혁신에 미치는 영향에 대하여 분석하였다. 은행 건전성 규제의 경우, 금융시장의 안정성 확보를 위한 건전성 규제(바젤 II)는 R&D 수행기업 간 양극화 현상을 가져올 수 있다. 유의할 사항은 일반적으로 자본금 규제가 신용등급이 낮은 중소기업 그룹에게 부정적 효과를 가져온다고 인식되고(손소영 2006), 우리의 연구도 이것을 뒷받침하고 있다. 하지만 실증분석 결과는 기술혁신 기업이라 하더라도 신용등급이 우수한 경우에는 바젤 II가 오히려 기회(opportunity)를 제공할 수 있으며 따라서 혁신자금 조달이 더 용이해질 수도 있다는 점을 보여준다. 다음으로, 금리규제는 금리 변동성이 기술혁신에 부정적인 영향을 미쳤던 것으로 나타났다. 또한 최근 진행되고 있는 금융기관 간 업무영역 규제의 완화와 이에 따른 업종간 겸업화 강화 경향이 R&D 투자에 긍정적인 영향을 미칠 가능성이 있음을 확인하였다.

  • PDF

AlGaAs/GaAs 레이저 다이오우드의 열처리에 의한 개선에 관한 연구 (Improvement of AlGaAs/GaAs Quantum Well Laser Diodes by Thermal Annealing)

  • Jung, Hyon-Pil;Kenzhou Xie;Wie, Chu-Ryang;Lee, Yun-Hyun
    • 한국통신학회논문지
    • /
    • 제18권3호
    • /
    • pp.449-455
    • /
    • 1993
  • 단거리 통신 시스팀의 광원으로 유용한 단파장 AlGaAs/GaAs레이저 다이오우드의 열악한 특성을 개선하기 위하여 MBE에 의해 낮은 온도에서 성장한 AlGaAs/GaAs GRINSCH-QW 레이저 다이오우드를 RTA온도의 변화에 좌우되는 포토루미네센스에 의하여 연구하였다. $950^{\circ}C$에서 10초동안 RTA처리를 한후 양자우물 포토루미네센스의 세기는 대체로 10배정도 증가하는것을 보여주었다. 이것은 양자우물 영역에서 발광되지 않는 재결합이 감소된것과 관련된다. 열처리된 레이저 다이오우드의 임계전류는 4배로 감소되었으며 RTA에 의하여 레이저 다이오우드의 질이 개선되었음이 확인되었다.

  • PDF

상추잎의 Paraquat 내성에 미치는 Nitric oxide의 영향 (Effect of Nitric Oxide on Paraquat-Tolerance in Lettuce Leaves)

  • 이지나;홍정희
    • 한국환경과학회지
    • /
    • 제20권12호
    • /
    • pp.1509-1519
    • /
    • 2011
  • The protective effect of nitric oxide (NO) on the antioxidant system under paraquat(PQ) stress was investigated in leaves of 8-week-old lettuce (Lactuca sativa L.) plants. PQ stress caused a decrease of leaf growth including leaf length, width and weight. Application of NO donor, sodium nitroprusside (SNP), significantly alleviated PQ stress induced growth suppression. SNP permitted the survival of more green leaf tissue preventing chlorophyll content reduction and of higher quantum yield for photosystem II than in non-treated controls under PQ exposure, suggesting that NO has protective effect on chloroplast membrane in lettuce leaves. Flavonoids and anthocyanin were significantly accumulated in the leaves upon PQ exposure. However, the rapid increase of these compounds was alleviated in the SNP treated leaves. PQ treatment resulted in lipid peroxidation and induced accumulation of hydrogen peroxide ($H_2O_2$) in the leaves, while SNP prevented PQ induced increase in malondialdehyde (MDA) and $H_2O_2$. These results demonstrate that SNP serves as an antioxidant agent able to scavenge $H_2O_2$ to protect plant cells from oxidative damage. The activities of two antioxidant enzymes that scavenge reactive oxygen species, superoxide dismutase (SOD) and catalase (CAT) in lettuce leaves in the presence of NO donor under PQ stress were higher than those under PQ stress alone. Application of 2-(4-carboxyphenyl)-4, 4, 5, 5-tetramethylimidazoline-1-oxyl-3-oxide (PTIO), a specific NO scavenger, to the lettuce leaves arrested SNP mediated protective effect on leaf growth, photosynthetic pigment and antioxidant systems. However, PTIO had little effect on lettuce leaves under PQ stress compared with that of PQ stress alone. The obtained data suggest that the damage caused by PQ stress is in part due to increased generation of active oxygen by maintaining increased antioxidant enzyme activities and SNP protects plants from oxidative stress. From these results it is suggested that NO might act as a signal in activating active oxygen scavenging system that protects plants from oxidative damage induced by PQ stress and thus confer PQ tolerance.

소형 Gifford-McMahon/Joule-Thomson 냉동기에서 열교환기의 최적 조합 (Optimum Size Combination of Heat Exchangers in a Small Gifford-Mchon/ Joule-Thomson Refrigerator)

  • 김영률;이상용;장호명
    • 대한기계학회논문집
    • /
    • 제16권11호
    • /
    • pp.2196-2202
    • /
    • 1992
  • 본 연구에서는 초전도 양자 간섭장치(SQUID, superconductiong quantum inte- rference device)를 냉각시킬 수 있는 정도의 소용량(3.995K에서 0.1W)의 GM/J-T 냉동 기에 대하여 요구되는 냉각용량을 만족시키면서 최대의 성능을 나타낼 수 있는 열교환 기의 면적배분 조건을 구하였다. 즉 냉동 성능을 알고 있는 상용 2단 GM 냉동기와 소형 극저온 냉동기에 널리 사용되는 열교환기로 이루어진 복합적인 GM/J-T 냉동기에 대하여 열교환기 총면적이 주어졌을 때, J-T 회로내의 냉매(헬륨)의 유량과 각 열교환 기 전열 면적의 비를 변수로 최적설계를 행하였다.

SQUID를 이용한 심자도 기술의 개발동향 (Review of Magnetocardiography Technology based on SQUIDs)

  • 이용호;권혁찬;김진목;김기웅;유권규;박용기
    • Progress in Superconductivity
    • /
    • 제13권3호
    • /
    • pp.139-145
    • /
    • 2012
  • Electric activity of cardiac muscles generates magnetic fields. Magnetocardiography (or MCG) technology, measuring these magnetic signals, can provide useful information for the diagnosis of heart diseases. It is already about 40 years ago that the first measurement of MCG signals was done by D. Cohen using SQUID (superconducting quantum interference device) sensor inside a magnetically shielded room. In the early period of MCG history, bulky point-contact RF-SQUID was used as the magnetic sensor. Thanks to the development of Nb-based Josephson junction technology in mid 1980s and new design of tightly-coupled DC-SQUID, low-noise SQUID sensors could be developed in late 1980s. In around 1990, several groups developed multi-channel MCG systems and started clinical study. However, it is quite recent years that the true usefulness of MCG was verified in clinical practice, for example, in the diagnosis of coronary artery disease. For the practical MCG system, technical elements of MCG system should be optimized in terms of performance, fabrication cost and operation cost. In this review, development history, technical issue, and future development direction of MCG technology are described.

Novel Erbium(III)-Encapsulated Complexes Based on ${\pi}$-Extended Anthracene Ligands Bearing G3-Aryl-Ether Dendron: Synthesis and Photophysical Studies

  • Baek, Nam-Seob;Kim, Yong-Hee;Roh, Soo-Gyun;Lee, Dong-Hyun;Seo, Kang-Deuk;Kim, Hwan-Kyu
    • Macromolecular Research
    • /
    • 제17권9호
    • /
    • pp.672-681
    • /
    • 2009
  • A series of inert and photo-stable Er(III)-encapsulated complexes based on ${\pi}$-extended dendritic anthracene ligands bearing G3-aryl-ether dendron ([G3-AnX]-$CO_2H$), which retain different ${\pi}$-bridging systems, such as single (X= S), double (X= D) and triple (X= T) bonds was designed and synthesized to establish the structure-property relationship. The near infrared emission intensities of Er(III)-encapsulated complexes were enhanced dramatically by increasing the ${\pi}$-conjugated extension of anthracene ligands. The time-resolved luminescence spectra show monoexponential decays with a lifetime of $2.0{\sim}2.4ms$ for $Er^{3+}$ ions in thin films, and calculated intrinsic quantum yields of $Er^{3+}$ ions are in the range of $0.025{\sim}0.03%$. As a result, all Er(III)-encapsulated dendrimer complexes exhibit the near IR emission with the following order: $Er^{3+}-[G3-AnD]_3$(terpy) > $Er^{3+}-[G3-AnS]_3$(terpy) ${\approx}$ $Er^{3+}-[G3-AnT]_3$(terpy), because $Er^{3+}-[G3-AnD]_3$(terpy) has a higher relatively spectral overlap J value and energy transfer efficiency. In addition, the lack of detectable phosphorescence and no significant spectral dependence of the ${\pi}$-extended anthracene moieties on the solvent polarity support energy transfer from their singlet state to the central $Er^{3+}$ ion taking place in $Er^{3+}-[G3-AnX]_3$(terpy).