• 제목/요약/키워드: Negative temperature coefficient

검색결과 245건 처리시간 0.028초

Molecular Dynamics Simulation Studies of Benzene, Toluene, and p-Xylene in NpT Ensemble: Thermodynamic, Structural, and Dynamic Properties

  • Kim, Ja-Hun;Lee, Song-Hi
    • Bulletin of the Korean Chemical Society
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    • 제23권3호
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    • pp.447-453
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    • 2002
  • In this paper we have presented the results of thermodynamic, structural, and dynamic properties of model systems for liquid benzene, toluene and p-xylene in an isobaric-isothermal (NpT) ensemble at 283.15, 303.15, 323.15, and 343.15 K using molecular dynamics (MD) simulation. This work is initiated to compensate for our previous canonical (NVT) ensemble MD simulations [Bull. Kor. Chem. Soc. 2001, 23, 441] for the same systems in which the calculated pressures were too low. The calculated pressures in the NpT ensemble MD simulations are close to 1 atm and the volume of each system increases with increasing temperature. The first and second peaks in the center of mass g(r) diminish gradually and the minima increase as usual for the three liquids as the temperature increases. The three peaks of the site-site gC-C(r) at 283.15 K support the perpendicular structure of nearest neighbors in liquid benzene. Two self-diffusion coefficients of liquid benzene via the Einstein equation and via the Green-Kubo relation are in excellent agreement with the experimental measures. The self-diffusion coefficients of liquid toluene and p-xylene are in accord with the trend that the self-diffusion coefficient decreases with increasing number of methyl group. The friction constants calculated from the force auto-correlation (FAC) function with the assumption that the fast random force correlation ends at time which the FAC has the first negative value give a correct qualitative trends: decrease with increase of temperature and increase with the number of methyl group. The friction constants calculated from the FAC's are always less than those obtained from the friction-diffusion relation which reflects that the random FAC decays slower than the total FAC as described by Kubo [Rep. Prog. Phys. 1966, 29, 255].

金屬이온의 폴라로그래프法的 파라미터에 미치는 壓力의 影響 (Effect of High Pressure on Polarographic Parameters of Metal Ions)

  • 이흥낙;배준웅;윤종훈
    • 대한화학회지
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    • 제28권5호
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    • pp.315-322
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    • 1984
  • 滴下水銀電極에서 0.1M KCl 수용액에 포함되어 있는 單純金屬이온 In(III), Cr(III), Cd(II), Pb(II), Mn(II), Co(II), Tl(I)의 還元에 대한 폴라로그래프법적 파라미터의 壓力에 따른 變化를 조사하였다. 溫度는 $25^{\circ}C$에서 $^35^{\circ}C$까지 變化시켰으며, 壓力은 1氣壓에서 1,800氣壓까지 300氣壓 單位로 바꾸었다. 壓力이 增加함에 따라 모든 金屬이온의 還元半波電位가 $8{\mu}V/atm\;{\sim}\;66{\mu}V/atm$ 정도 陰電位쪽으로 移動하였으며, 擴散電流의 값은 $1.3{\times}10-3%/atm\;{\sim}\;2.3{\times}10-2%/atm$ 정도 增加하였다. 또한 壓力이 增加함에 따라 각 加電壓 E와 log[$\frac{id-i)}{i}$]를 plot하여 얻은 直線의 기울기가 커지는 것으로부터 壓力을 增加함에 따라 還元反應의 可逆性이 減少한다는 事實을 알 수 있었다. 한편 $25^{\circ}C\;{\sim}\;35^{\circ}C$의 범위에서 구한 溫度係數는 壓力增加에 따라 크게 변하지 않았다.

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자기 통전식 SiC세라믹 발열체 개발을 위한 기초 특성 연구 (Study of Basic Properties to Develope SiC Ceramic Heater by Self-Charge with Electricity)

  • 신용덕;고태헌;주진영
    • 대한전기학회:학술대회논문집
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    • 대한전기학회 2007년도 Techno-Fair 및 추계학술대회 논문집 전기물성,응용부문
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    • pp.124-125
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    • 2007
  • The composites were fabricated $\beta$-SiC and $TiB_2$ powders with the liquid forming additives of 8, 12, 16[wt%] $Al_2O_3+Y_2O_3$ as a sintering aid by pressureless annealing at $1,650[^{\circ}C]$ for 4 hours. Reactions between SiC and transition metal $TiB_2$ were not observed in the microstructure and the phase analysis of the pressureless annealed SiC-$TiB_2$ electroconductive ceramic composites. The relative density, the flexural strength, the Young's modulus and the Vicker's hardness showed the highest value of 82.29[%], 189.5[MPa], 54.60 [GPa] and 2.84[GPa] for SiC-$TiB_2$ composites added with 16[wt%] $Al_2O_3+Y_2O_3$ additives at room temperature. The relative density of SiC-$TiB_2$ composites was lowered due to gaseous products of the result of reaction between SiC and $Al_2O_3+Y_2O_3$. The electrical resistivity showed the lowest value of 0.012[${\Omega}{\cdot}cm$] for 16[wt%] at 25[$^{\circ}C$]. The electrical resistivity was all negative temperature coefficient resistance (NTCR) in the temperature ranges from 25[$^{\circ}C$] to 700[$^{\circ}C$].

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Active Reaction Sites and Oxygen Reduction Kinetics on $La_1_{-x}Sr_xMnO_{3+\delta}$(x=0.1-0.4)/YSZ (Yttria-Stabilized Zirconia) Electrodes for Solid Oxide Fuel Cells

  • Lee, Hee Y.;Cho, Woo S.;오승모
    • Bulletin of the Korean Chemical Society
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    • 제19권6호
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    • pp.661-666
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    • 1998
  • Active reaction sites and electrochemical O2 reduction kinetics on La_{1-x}Sr_xMnO_{3+{\delta}} (x=0.1-0.4)/YSZ (yttria-stabilized zirconia) electrodes are investigated in the temperature range of 700-900 ℃ at $Po_2=10^{-3}$-0.21 atm. Results of the steady-state polarization measurements, which are formulated into the Butler-Volmer formalism to extract transfer coefficient values, lead us to conclude that the two-electron charge transfer step to atomically adsorbed oxygen is rate-limiting. The same conclusion is drawn from the $Po_2$-dependent ac impedance measurements, where the exponent m in the relationship of $I_o$ (exchange current density) ∝ $P_{o_{2}}^m$ is analyzed. Chemical analysis is performed on the quenched Mn perovskites to estimate their oxygen stoichiometry factors (δ) at the operating temperature (700-900 ℃). Here, the observed δ turns out to become smaller as both the Sr-doping contents (x) and the measured temperature increase. A comparison between the 8 values and cathodic activity of Mn perovskites reveals that the cathodic transfer coefficients $({\alpha}_c)$ for oxygen reduction reaction are inversely proportional to δ whereas the anodic ones $({\alpha}_a)$ show the opposite trend, reflecting that the surface oxygen vacancies on Mn perovskites actively participate in the $O_2$ reduction reaction. Among the samples of x= 0.1-0.4, the manganite with x=0.4 exhibits the smallest 8 value (even negative), and consistently this electrode shows the highest ${\alpha}_c$ and the best cathodic activity for the oxygen reduction reaction.

TiNxOy/TiNx 다층 박막을 이용한 고저항 박막 저항체의 구조 및 전기적 특성평가 (Structural and Electrical Properties High Resistance of TiNxOy/TiNx Multi-layer Thin Film Resistors)

  • 박경우;허성기;;안준구;윤순길
    • 대한금속재료학회지
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    • 제47권9호
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    • pp.591-596
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    • 2009
  • $TiN_xO_y/TiN_x$ multi-layer thin films with a high resistance(${\sim}k{\Omega}$) were deposited on $SiO_2/Si$ substrates at room temperature by sputtering. The $TiN_x$ thin films show island and smooth surface morphology in samples prepared by ${\alpha}$ and RF magnetron sputtering, respectively. $TiN_xO_y/TiN_x$ multi-layer in has been developed to control temperature coefficient of resistance(TCR) by the incorporation of $TiN_x$ layer(positive TCR) inserted into $TiN_xO_y$ layers(negative TCR). Electrical and structural properties of sputtered $TiN_xO_y/TiN_x$ multi-layer films were investigated as a function of annealing temperature. In order to achieve a stable high resistivity, multi-layer films were annealed at various temperatures in oxygen ambient. Samples annealed at $700^{\circ}C$ for 1 min exhibited good TCR value of approximately $-54 ppm/^{\circ}C$ and a stable high resistivity around $20k{\Omega}/sq$. with good reversibility.

N형 SiC 반도체의 열전 물성에 미치는 적층 결함의 영향 (The Effect of Stacking Fault on Thermoelectric Property for n-type SiC Semiconductor)

  • 배철훈
    • 한국산학기술학회논문지
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    • 제22권3호
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    • pp.13-19
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    • 2021
  • n형 SiC 반도체에서 적층 결함이 열전 물성에 미치는 영향에 대해 연구하였다. ��-SiC 분말 성형체를 질소 분위기에서 1600~2100 ℃, 20~120분간 열처리해서 30~42 %의 기공률을 갖는 다공질 SiC 반도체를 제작하였다. X선 회절 분석으로 적층 결함량, 격자 스트레인 및 격자 상수를 산출하였고, 미세 구조 분석을 위해서 기공률 및 비표면적 측정과 함께, 주사 전자현미경 (SEM), 투과 전자현미경 (TEM) 및 고분해능 전자현미경 (HREM) 등을 관찰하였다. Ar 분위기 550~900 ℃에서 도전율과 Seebeck 계수를 측정 및 산출하였다. 열처리 온도가 높을수록, 처리 시간이 길어질수록 캐리어 농도 증가 및 입자와 입자간의 연결성 향상에 의해 도전율이 향상되었다. 도너로 작용하는 질소의 고용으로 Seebeck 계수는 음(-)의 값을 나타내었고, 도전율과 마찬가지로 열처리 온도 및 시간이 상승함에 따라 Seebeck 계수의 절대 값이 증가하였다. 이는 적층 결함의 감소, 즉 입자 및 결정 성장과 함께 적층 결함 밀도의 감소에 의해 포논의 평균 자유 행정이 증가해서 결과적으로 포논-드랙 효과에 의한 Seebeck 계수의 향상으로 나타난 것으로 판단된다.

적외선 센서용 [(Co1-xCux)0.2(Ni0.3Mn0.7)0.8]3O4 스피넬 박막의 구조 및 전기적 특성 (Structural and Electrical Properties of [(Co1-xCux)0.2(Ni0.3Mn0.7)0.8]3O4 Spinel Thin Films for Infrared Sensor Application)

  • 이귀웅;전창준;정영훈;윤지선;조정호;백종후;윤종원
    • 한국전기전자재료학회논문지
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    • 제27권12호
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    • pp.825-830
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    • 2014
  • $[(Co_{1-x}Cu_x)_{0.2}(Ni_{0.3}Mn_{0.7})_{0.8}]_3O_4$ ($0{\leq}x{\leq}1$) thin films prepared by metal organic decomposition process were fabricated on SiN/Si substrate for infrared sensor application. Their structural and electrical properties were investigated with variation of Cu dopant. The $[(Co_{1-x}Cu_x)_{0.2}(Ni_{0.3}Mn_{0.7})_{0.8}]_3O_4$ (CCNMO) film annealed at $500^{\circ}C$ exhibited a dense microstructure and a homogeneous crystal structure with a cubic spinel phase. Their crystallinity was further enhanced with increasing doped Cu amount. The 120 nm-thick CCNMO (x=0.6) thin film had a low resistivity of $53{\Omega}{\cdot}cm$ at room temperature while the Co-free film (x=1) showed a significantly decreased resistivity of $5.9{\Omega}{\cdot}cm$. Furthermore, the negative temperature coefficient of resistance (NTCR) characteristics were lower than $-2%/^{\circ}C$ for all the specimens with $x{\geq}0.6$. These results imply that the CCNMO ($x{\geq}0.6$) thin films are a good candidate material for infrared sensor application.

고압하에서의 이소퀴놀린과 브롬화 벤질류의 반응에 관한 속도론적인 연구 (Kinetic Study on the Reaction of para-substitued Benzylbromide with Isoquinoline under High Pressure)

  • 김영철;임종완;최성용
    • 대한화학회지
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    • 제42권2호
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    • pp.150-155
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    • 1998
  • Acetonitrile 용매내에서 isoquinoline과 치한된 benzylbromide의 반응을 압력변화(1~1000bar)에 따라 반응속도론적으로 연구하였다. 속도상수로부터 활성화파라미터들을 TEX>$\(DeltaV^{\neq}, \Delta\beta^{\neq}, \DeltaH^{\neq}, \DeltaS^{\neq}, \DeltaG^{\neq},Ea)$구하였다. 온도가 증가함에 따라 속도상수는 증가 하고, TEX>$\DeltaV^{\neq}, \Delta\beta^{\neq},및 \DeltaS^{\neq}$는 모두 음의 값으로 나타내었다. 치환기효과와 실험 결과로 부터 반응메카니즘을 고찰한 결과 전체적인 반응은 $S_{N}2$반응 메카니즘으로 진행되나, 치환체와 압력변화에 따라 전이상태 구조에 약간의 변화가 있었다.

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Design of the Voltage-Controlled Sinusoidal Oscillator Using an OTA-C Simulated Inductor

  • Park, Ji-Mann;Chung, Won-Sup;Park, Young-Soo;Jun, Sung-Ik;Chung, Kyo-Il
    • 대한전자공학회:학술대회논문집
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    • 대한전자공학회 2002년도 ITC-CSCC -2
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    • pp.770-773
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    • 2002
  • Two sinusoidal voltage-controlled oscillators using linear operational transconductance amplifiers are presented in this paper: One is based on the positive-feedback bandpass oscillator model and the other on the negative-feedback Colpitts model. The bandpass VCO consists of a noninverting amplifier and a current-controlled LC-tuned circuit which is realized by two linear OTA's and two grounded capacitors, while the Colpitts VCO consists of an inverting amplifier and a current-controlled LC-tuned circuit realized by three linear OTA's and three grounded capacitors. Prototype circuits have been built with discrete components. The experimental results have shown that the Colpitts VCO has a linearity error of less than 5 percent, a temperature coefficient of less than rm 100 ppm/$^{circ}C$, and a $pm1.5 Hz $frequency drift over an oscillation frequency range from 712Hz to 6.3kHz. A total harmonic distortion of 0.3 percent has been measured for a 3.3kHz oscillation and the corresponding peak-to-peak amplitude was 1V. The experimental results for bandpass VCO are also presented.

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다변량 통계분석을 이용한 낙동강 창녕함안보 구간의 수질 특성 평가 (The Evaluation of Water Quality Using a Multivariate Analysis in Changnyeong-Haman weir section)

  • 곽보라;김일규
    • 상하수도학회지
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    • 제29권6호
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    • pp.625-632
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    • 2015
  • The study of water environment system using a multivariate analysis in Changnyeong-Haman weir section has been conducted. The purpose of this study is to establish better understanding related water qualities in the Changnyeong-Haman weir section which can provide useful information. The data were consisted of water quality data and algae data including WT(water temperature), pH, DO, EC, COD, SS, T-N, $NH_3-N$, T-P, $PO_4-P$, Chl-a, TOC, d-silica, t-silica, Cyanobacteria, Diatoms, and Green algae. Statistical analyses used in this study were correlation analysis, principal components, and factor analysis. According to correlation analysis on COD and TOC, it revealed that the each value of correlation coefficient was 0.843. On the other result, a negative correlation was observed between diatoms and d-silica. Furthermore, the results of principal component analysis to the overall water quality were classified into four main factors with contribution rate 81.071%.