• 제목/요약/키워드: 3 D.O.F

검색결과 779건 처리시간 0.032초

Refinement of the structure of naproxen, (+)-6- methoxy-$\alpha$-methyl-2-naphthaleneacetic acid

  • Kim, Yang-Bae;Song, Hyun-June;Park, Il-Yeong
    • Archives of Pharmacal Research
    • /
    • 제10권4호
    • /
    • pp.232-238
    • /
    • 1987
  • The molecular structure of naproxen determined by X-ray diffraction technique was refine to the final R-value geing 0.042. The compound was recrystallized from ethanol solution in monoclinic crystal system, space group $P2_1$ , with Z = 2, a = 13.375(5) $\AA$, b = 5.793(2) $\AA$, c = 7.914 $\AA$, $\beta$=93.91(3)$\AA$ and $d_{obs}$ = 1.26, $d_{calc}$ = 1.25 g/cm$^{3}$. The structure was solved by direct method and refined by block diagonal least squares procedure for 747 relfections (F .leq. 6.sigma.(F)). The molecules are connected by two intermolecular OH--O type hydrogen bonds.

  • PDF

Au Deposition Effect on Amorphous In-Ga-Zn-O Thin Film Investigated by High-Resolution x-ray Photoelectron Spectroscopy

  • 강세준;백재윤;신현준
    • 한국진공학회:학술대회논문집
    • /
    • 한국진공학회 2012년도 제43회 하계 정기 학술대회 초록집
    • /
    • pp.301-301
    • /
    • 2012
  • Amorphous In-Ga-Zn-O (a-IGZO)는 광학적으로 투명하고 높은 전자이동도를 가지고 있어서 차세대 thin-film-transistor의 channel layer 물질로 각광받고 있다. 이러한 a-IGZO를 TFT channel layer로 사용하기 위해서는 소스 드레인 전극물질과 IGZO박막의 계면에서 ohmic contact을 만드는 것도 중요하다. 하지만 산화물 반도체의 특성상 금속물질을 증착시킬 때 산화금속계면을 형성하기 때문에 ohmic contact이 형성되기 어려운 것으로 알려져 있다. Au는 보통 전극물질로 많이 사용되는데, 이는 전기전도도가 매우 높고, 독특한 산화환원반응 특성을 보이지만, 화학반응을 잘 일으키지 않는 안정성을 가지는 성질에 기인한다. 본 연구진은 Au가 a-IGZO에 증착 시에 일어나는 표면의 화학적 상태변화를 이해하기 위해 방사광을 이용한 고분해능 광전자 분광법을 이용하여 표면변화를 분석하였다. Au는 (Au 4f) 증착 초기엔 약간의 gold oxide가 함께 형성되지만, 주로 metal gold의 형태로 존재하였다. In 3d, Ga 3d, O 1s, Zn 3d 각각의 스펙트럼에서는 Au 증착으로 인해 낮은 결합에너지에 새로운 state가 나타났다. 한편, In은 상대적으로 다른 원소들에 비해 Au와 좀 더 결합을 잘 하는 것으로 나타났는데 이는, In 5s 전자궤도가 전도메커니즘에서 중요한 역할을 하기 때문에, In-Au의 상대적인 강한 결합은 a-IGZO의 전기적 특성 변화에 기여할 수 있음을 의미한다.

  • PDF

귀룽나무의 쎄레브로사이드 및 페놀성 성분 (Cerebrosides and Phenolic Constituents of Prunus padus L.)

  • 나대수;양민철;이규하;이강노
    • 생약학회지
    • /
    • 제37권3호
    • /
    • pp.125-129
    • /
    • 2006
  • The chromatographic separation of n-BuOH extract of the aerial parts of Prunus padus (Rosaceae) led to the isolation of two cerebrosides, and six phenolic compounds. Their structure were identified to be pinelloside (1), soyacebroside I (2), $quercetin-3-O-{\beta}-D-galactopyranoside$ (3), nudiposide (4), (+)-isolarisiresinol $9'-O-{\beta}-D-xylopyroanoside$ (5), khaephuoside A (6) and icariside F2(7) by physicochemical and spectroscopic methods. The compounds $1,5{\sim}7$ are first isolated from the genus Prunus.

Electronic Structure of Ce-doped ZrO2 Film: Study of DFT Calculation and Photoelectron Spectroscopy

  • Jeong, Kwang Sik;Song, Jinho;Lim, Donghyuck;Kim, Hyungsub;Cho, Mann-Ho
    • Applied Science and Convergence Technology
    • /
    • 제25권1호
    • /
    • pp.19-24
    • /
    • 2016
  • In this study, we evaluated the change of electronic structure during redox process in cerium-doped $ZrO_2$ grown by sol gel method. By sol-gel method, we could obtain cerium-doped $ZrO_2$ in high oxygen partial pressure and low temperature. After post annealing process in nitrogen ambient, the film is deoxidized. We used spectroscopic and theoretical methods to analysis change of electronic structure. X-ray absorption spectroscopy (XAS) for O K1-edge and Density Functional Theory (DFT) calculation using VASP code were performed to verify the electronic structure of the film. Also, high resolution x-ray photoelectron spectroscopy (HRXPS) for Ce 3d was carried out to confirm chemical bond of cerium doped $ZrO_2$. Through the investigation of the electronic structure, we verified as followings. (1) During reduction process, binding energy of oxygen is increase. Simultaneously, oxidation state of cerium was change to 4+ to 3+. (2) Cerium 4+ and cerium 3+ states were generated at different energy level. (3) Absorption states in O K edge were mainly originated by Ce 4+ $f_0$ and Ce 3+, while occupied states in valance band were mainly originated from Ce 4+ $f_2$.

Synthesis of Fully Dehydrated Partially Cs+-exchanged Zeolite Y (FAU, Si/Al = 1.56), |Cs45Na30|[Si117Al75O384]-FAU and Its Single-crystal Structure

  • Seo, Sung-Man;Kim, Ghyung-Hwa;Lee, Seok-Hee;Bae, Jun-Seok;Lim, Woo-Taik
    • Bulletin of the Korean Chemical Society
    • /
    • 제30권6호
    • /
    • pp.1285-1292
    • /
    • 2009
  • Large single crystals of zeolite, |$Na_{75}$|[$Si_{117}Al_{75}O_{384}$]-FAU (Na-Y, Si/Al = 1.56), were synthesized from gels with composition of 3.58Si$O_2$ : 2.08NaAl$O_2$ : 7.59NaOH : 455$H_2$O : 5.06TEA : 2.23TCl. One of these, a colorless single-crystal was ion exchanged by allowing aqueous 0.02 M CsOH to flow past the crystal at 293 K for 3 days, followed by dehydration at 673 K and 1 ${\times}\;10^{-6}$ Torr for 2 days. The crystal structure of fully dehydrated partially $Cs^+$-exchanged zeolite Y, |$Cs_{45}Na_{30}$|[$Si_{117}Al_{75}O_{384}$]-FAU per unit cell (a = 24.9080(10) $\AA$) was determined by single-crystal X-ray diffraction technique in the cubic space group Fd $\overline{3}$ m at 294(1) K. The structure was refined using all intensities to the final error indices (using only the 877 reflections with $F_o\;>\;4{\sigma}(F_o))\;R_1$ = 0.0966 (Based on F) and $R_2\;=\;0.2641\;(Based\;on\;F^2$). About forty-five $Cs^+$ ions per unit cell are found at six different crystallographic sites. The 2 $Cs^+$ ions occupied at site I, at the centers of double 6-ring (D6Rs, Cs-O = 2.774(10) $\AA$ and O-Cs-O = 88.9(3) and 91.1(3)$^o$). Two $Cs^+$ ions are found at site I’ in the sodalite cavity; the $Cs^+$ ions were recessed 2.05 $\AA$ into the sodalite cavity from their 3-oxygen plane (Cs-O = 3.05(3) $\AA$ and O-Cs-O = 77.4(13)$^o$). Site-II’ positions (opposite single 6-rings in the sodalite cage) are occupied by 7 $Cs^+$ ions, each of which extends 2.04 $\AA$ into the sodalite cage from its 3-oxygen plane (Cs-O = 3.067(11) $\AA$ and O-Cs-O = 80.1(3)$^o$). The 26 $Cs^+$ ions are nearly three-quarters filled at site II in the supercage, being recessed 2.34 $\AA$ into the supercage (Cs-O = 3.273(8) $\AA$ and O-Cs-O = 74.3(3)$^o$). The 4 $Cs^+$ ions are found at site III deep in the supercage (Cs-O = 3.321(19) and 3.08(3) $\AA$), and 4 $Cs^+$ ions at another site III’ (Cs-O = 2.87(4) and 3.38(4) $\AA$). About 30 $Na^+$ ions per unit cell are found at one crystallographic site; The $Na^+$ ions are located at site I’ in the sodalite cavity opposite double 6-rings (Na-O = 2.578(11) $\AA$ and O-Na-O = 97.8(4)$^o$).

비냉각 검출기를 위한 BSCT 후막의 제작과 특성 분석 (The fabrication and analysis of BSCT thick films for uncooled infrared detectors)

  • 노현지;이성갑;배선기
    • 대한전기학회:학술대회논문집
    • /
    • 대한전기학회 2008년도 Techno-Fair 및 추계학술대회 논문집 전기물성,응용부문
    • /
    • pp.171-172
    • /
    • 2008
  • $(Ba_{0.57}Sr_{0.33}Ca_{0.10})TiO_3$ (BSCT) thick films doped with 0.1 mol% $MnCO_3$ and $Yb_2O_3$ ($0.1{\sim}0.7$ mol%) were fabricated by the screen printing method on the alumina substrate. And the structural and electrical properties as a function of $Yb_2O_3$ amount were investigated. The lattice constants of the BSCT thick film doped with 0.1 mol% is 0.3955 nm. The specimen doped with 0.7 mol% $Yb_2O_3$ showed dense and uniform grains with diameters of about 6.3 mm. The thickness of all BSCT thick films was approximately 60 mm. The Curie temperature of the BSCT specimen doped with 0.1 mol% $Yb_2O_3$ was $18^{\circ}C$, and the dielectric constantand dielectric loss at this temperature was 4637 and 4.2%, respectively. The BSCT specimen doped with 0.1 mol% $Yb_2O_3$ showed the maximum value of $349{\times}10^{-9}C/cm^2K$ at Curie temperature. The figure of merit $F_D$ for specific detectivity of the specimens doped with 0.1 mol% $Yb_2O_3$ showed the highest value of $10.9{\times}10^{-9}Ccm/J$.

  • PDF

규불화아연(ZnSiF6, aq)이 첨가된 시멘트의 유동성과 수화특성 (Fluidity and Hydration Properties of Cement Paste Added Zinc Fluosilicate(ZnSiF6, aq.))

  • 김도수;길배수;임헌성;남재현;노재성
    • 한국세라믹학회지
    • /
    • 제39권2호
    • /
    • pp.178-183
    • /
    • 2002
  • 금속염으로 산화아연(ZnO)과 규불화수소산($H_2SiF_6$)을 이용하여 용액법으로 규불화아연($ZnSiF_6$, 농도 15%)을 제조하고 이를 시멘트용 혼화제로 첨가하여 시멘트의 유동성과 수화특성에 미치는 영향을 파악하였다. 규불화아연의 첨가량을 시멘트량 대비 1.0∼4.0%로 증가시켜 첨가한 시멘트 페이스트의 초기 유동성과 유동성의 경시변화를 측정하였다. 초기 유동성은 mini-slump 시험을 통해 평가하였고, 유동성의 경시변화는 slump loss 시험을 통해 평가하였다. 또한 규불화아연을 시멘트에 1.0∼3.0%로 첨가하였을 때 시멘트의 응결시간에 미치는 영향과 시멘트 수화열 변화에 미치는 영향을 파악하였다. 시멘트 페이스트의 유동성은 규불화아연이 2.1% 첨가되었을 때 가장 높게 나타났으나 경시변화는 다소 큰 것으로 나타났다. 시멘트 응결시간은 규불화아연의 첨가량 증가에 따라 지연되는 특성을 보였으며, 시멘트 수화열은 첨가량에 비례하여 감소되는 경향을 보였다.

플루오르화메탄들과 암모니아 및 물과의 수소결합 이량체들에 관한 Ab Initio 연구 (Ab Initio Studies on Hydrogen-Bonded Dimers of Fluoromethanes with Ammonia and Water)

  • 이순기;김승훈
    • 대한화학회지
    • /
    • 제37권4호
    • /
    • pp.408-415
    • /
    • 1993
  • $CH_4,\;CH_3F,\;CH_2F_2,\;CHF_3$$NH_3$H_2O$와의 수소결합 이량체들에 대하여 9s5p/5s 및 9s5p1d/5s1p의 basis sets를 사용하여 체계적인 ab initio 계산을 하였다. 이들 이량체들의 바닥상태성질을 구하여 독립된 단위체들의 대응하는 성질과 비교하였으며, 평형기하구조, 안정화에너지, 쌍극자모멘트 및 분자간 결합의 힘상수 등을 보고하였다. 사슬형 소중합체들에서 수소결합의 비가감적 거동의 결과로부터 일어나는 여러가지 효과들을 논의하고, SCF 근사법의 사용에 따른 체계적 및 조직적인 오차들과 계산결과들의 basis sets 의존성을 지적하였다.

  • PDF

Cytotoxic Effect and Constituent Profile of Alkaloid Fractions from Ethanolic Extract of Ficus septica Burm. f. Leaves on T47D Breast Cancer Cells

  • Nugroho, Agung Endro;Akbar, Fiki Fatihah;Wiyani, Anggie;Sudarsono, Sudarsono
    • Asian Pacific Journal of Cancer Prevention
    • /
    • 제16권16호
    • /
    • pp.7337-7342
    • /
    • 2015
  • The study aimed to investigate the profile of alkaloids in two ethyl acetate soluble fractions, namely fractions A and B from an ethanolic extract of Ficus septica leaves and cytotoxic effect on T47D breast cancer cells. Preparation of both fractions involved maceration of leaves with 70% (v/v) ethanol, filtration with $Al_2O_3$, precipitation with 0.1 N HCl, Mayer reagent, and 0.1 N NaOH, and also partition with ethyl acetate. Qualitative thin layer chromatography (TLC) was conducted to determine the profile of alkaloids in the two fractions, using alkaloid specific reagents such as Dragendorff, sodium nitrite, and Van Urk-Salkowski. Cytotoxic effects of both fractions on T47D cells were evaluated using MTT assay with a concentration series of 1.56; 3.12; 6.25; 12.5; 25 and $50{\mu}g/mL$. The TLC test showed that fractions A and B contained alkaloids with Rx values of 0.74 and 0.80 for fraction A and 0.74, 0.84, 0.92 for fraction B with regard to yohimbine using the mobile phase of n-buthanol:glacial acetic acid:distilled water (3:1:1 v/v/v). Moreover, an indole alkaloid was detected with Rx values of 0.80 and 0.84, respectively. Fractions A and B exhibited high cytotoxic effects on T47D cells with IC50 values of 2.57 and $2.73{\mu}g/mL$, respectively. In conclusion, overall the results of this study showed that fractions of Ficus septica contain alkaloids including indole alkaloid or its derivatives and possess a cytotoxic effect on T47D cells. This research supports the idea that alkaloids in F. septica have anticancer activity.

벼 흰빛잎마름병 저항성유전에 관한 연구 (Inheritance of Resistance to Bacterial Leaf Blight Caused by Xanthomonas oryzae (Uyeda at Isheyama) Dowson in Rice)

  • 손재근;김문호
    • 한국응용곤충학회지
    • /
    • 제19권3호
    • /
    • pp.156-162
    • /
    • 1980
  • 벼 흰빛잎마름병의 저항성의 품종간 차이와 그 유전양식을 조사하여 저항성품종육성의 기초자료로 활용코저 몇 가지 시험을 수행하여 얻어진 결과는 다음과 같다. 1. 최고분얼기와 출수기때의 저항성정도는 품종에 따라 상이한 반응을 보였고 공시품종중에서 IR2061-465-1-5-5, IR2061-553-6-9, IR1561-228-3-3, 밀양 42호는 공시된 3균주에 대해 최고분얼기나 출수기에 모두 높은 저항성을 보였다. 2. 질적저항성이 동일한 품종군에 속하는 품종중에서도 저항성정도의 양적인 차이는 크게 인정되었고, 그 차는 품종군별로는 밀양 23호군에서 균주별로는 II 균군에서 크게 나타났다. 3. IR2061-465-1-5-5와 IR1561-228-3-3의 II균군에 대한 저항성의 유전은 $F_1,F_2$$F_3$ 세대의 분리양상으로 보아 $1\~2$개의 유전인자에 의해 저항성이 지배된다고느 보기 어렵고 상당수의 유전인자가 이에 관여하는 것으로 생각된다.

  • PDF