• 제목/요약/키워드: Theoretical

검색결과 21,268건 처리시간 0.043초

Theoretical Analysis on Molecular Magnetic Properties of N-Confused Porphyrins and Its Derivatives

  • Wei, Wei;Bai, Fu-Quan;Xia, Bao-Hui;Zhang, Hong-Xing
    • Bulletin of the Korean Chemical Society
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    • 제33권9호
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    • pp.2937-2942
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    • 2012
  • We have theoretically investigated the magnetic properties of N-confused porphyrin (NCP), tetraphenyl-N-confused porphyrin (TPNCP) and their substituted derivatives with O, S and Se heteroatoms (2ONCP, 2STPNCP, 2SeNCP, 2OTPNCP, etc.) by using DFT method. In the minimum energy structures of the 2OTPNCP, the two couples opposite phenyl substitutes are staggered. In the case of TPNCP, 2STPNCP and 2SeTPNCP, two phenyls being respectively close to or opposite to N-confused pyrrole are found to be pointed the same direction, whilst others are in the opposite direction. Based on the equilibrium structures, the $^1H$ chemical shifts and nucleus-independent chemical shifts (NICS) are calculated in this paper. The ${\pi}$ current density being induced by the tridimensional perpendicular magnetic field transmits the inner section of the pyrrole segments for NCP and TPNCP. As for their substituted derivatives with O, S and Se atoms, the current path passes through the outer section of the two heterorings. The NICS values at the ring critical points of the heterorings are much lower (in absolute value) than those of which is at the center of an isolated pyrrole molecule. The $^1H$ NMR for ${\beta}H$ atoms of the heterorings decreases from O, S to with Se.

수술 직후 암 환자의 희망증진 간호를 위한 이론 모델 개발 : 현실적 희망 (A Theoretical Model of Hope Enhancing the Cancer Patients just after Surgery: Realistic Hope)

  • 김달숙;박인숙
    • 성인간호학회지
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    • 제18권1호
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    • pp.115-124
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    • 2006
  • Purpose: The purpose of this study was to propose a theoretical model of hope commonly held by the cancer patients just after surgery, under the assumptions that hope of those patients is not only realistic and disease oriented but in dialectical circulation. Method: A theoretical model was generated through 4 steps: exploring a hope structure by synthesizing the relevant hope structures expressed in Kim and Tae's studies, in-depth literature review, examining the meanings of the concepts consisted of the structure in use and their causal relations in logical adequacy, proposing a theoretical structure through synthesizing the causal relations, and diagramming the structure. Results: The proposed theoretical model involves concepts such as Cancer Related Uncertainty (CRU), Efforts to Find out the Possibility of Cure or Recovery (EFPCR), and Hopefulness or Hopelessness. The 'EFPCR' is stipulated as 'Behaviors Related to Looking for Evidences or Cues (BRLEC)' and 'Formation of Cognitive Schema (FCS)'. In the model, Hopefulness is directly influenced by 'CRU in low', which is affected by 'FCS in good' from the result of EFPCR started with 'CRU in increase' while 'CRU with increase' from the result from EFPCR has direct effect on Hopelessness. Conclusion: The theoretical model would be used to enhancing hope of the cancer patients in post-operation.

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Study on Theoretical Models of Regional Humanity Lung Cancer Hazards Assessment

  • Zhang, Chuan;Gao, Xing
    • Asian Pacific Journal of Cancer Prevention
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    • 제16권5호
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    • pp.1759-1764
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    • 2015
  • Purpose: To establish the concept of lung cancer hazard assessment theoretical models, evaluating the degree of lung cancer risk of Beijing for regional population lung cancer hazard assessment to provide a basis for technical support. Materials and Methods: ISO standards were used to classify stratified analysis for the entire population, life cycle, processes and socioeconomic management. Associated risk factors were evaluated as lung cancer hazard risk assessment first class indicators. Study design: Using the above materials, indicators were given the weight coefficients, building lung cancer risk assessment theoretical models. Regional data for Beijing were entered into the theoretical model to calculate the parameters of each indicator and evaluate the degree of local lung cancer risk. Results: Adopting the concept of lung cancer hazard assessment and theoretical models for regional populations, we established a lung cancer hazard risk assessment system, including 2 first indicators, 8 secondary indicators and 18 third indicators. All indicators were given weight coefficients and used as information sources. Score of hazard for lung cancer was 84.4 in Beijing. Conclusions: Comprehensively and systematically building a lung cancer risk assessment theoretical model for regional populations in conceivable, evaluating the degree of lung cancer risk of Beijing, providing technical support and scientific basis for interventions for prevention.

기판에 인접한 미소거울의 회전 점성감쇠 (Potational Viscous Damping of On-substrate Micromirrors)

  • 김응삼;한기호;조영호;김문언
    • 대한전기학회논문지:전기물성ㆍ응용부문C
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    • 제50권5호
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    • pp.243-248
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    • 2001
  • In this paper, we present theoretical and experimental study on the viscous damping of the on-substrate torsional micromirrors, oscillating near the silicon substrates. In this theoretical study, we develop theoretical models and test structures for the viscous damping of the on-substrate torsional micromirrors. From a finite element analysis, we estimate the theoretical damping coefficients of the torsional micromirrors. From a finite element analysis, we estimate the theoretical damping coefficients of the torsional micromirrors, fabricated by the surface-micromaching process. From the electrostatic test of the fabricated devices, frequency-dependent rotationalvelocity of the micromirrors has been measured at the atmospheric pressure using devices, frequency-dependent rotational velocity of the micromirrors has been measured at the atmospheric pressure using the Mach-Zehnder interferometer system. Experimental damping coefficients have been extracted from the least square fit of the measured rotational velocity within the filter bandwidth of 150 kHz. We have compared the theoretical values and the experimental results on the dynamic performance of the micromirrors. The theoretical analysis overstimates the resonant frequency in the amount of 15%, while underestimating the viscous damping in the factors of 10%.

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Experimental and Theoretical Study on the Prediction of Axial Stiffness of Subsea Power Cables

  • Nam, Woongshik;Chae, Kwangsu;Lim, Youngseok
    • 한국해양공학회지
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    • 제36권4호
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    • pp.243-250
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    • 2022
  • Subsea power cables are subjected to various external loads induced by environmental and mechanical factors during manufacturing, shipping, and installation. Therefore, the prediction of the structural strength is essential. In this study, experimental and theoretical analyses were performed to investigate the axial stiffness of subsea power cables. A uniaxial tensile test of a 6.5 m three-core AC inter-array subsea power cable was carried out using a 10 MN hydraulic actuator. In addition, the resultant force was measured as a function of displacement. The theoretical model proposed by Witz and Tan (1992) was used to numerically predict the axial stiffness of the specimen. The Newton-Raphson method was employed to solve the governing equation in the theoretical analysis. A comparison of the experimental and theoretical results for axial stiffness revealed satisfactory agreement. In addition, the predicted axial stiffness was linear notwithstanding the nonlinear geometry of the subsea power cable or the nonlinearity of the governing equation. The feasibility of both experimental and theoretical framework for predicting the axial stiffness of subsea power cables was validated. Nevertheless, the need for further numerical study using the finite element method to validate the framework is acknowledged.

등가 드로우비드 이론 모델 검증 (Verification of Theoretical Model for Equivalent Drawbend)

  • 문성준;금영탁
    • 한국소성가공학회:학술대회논문집
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    • 한국소성가공학회 2008년도 추계학술대회 논문집
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    • pp.367-369
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    • 2008
  • A theoretical model of equivalent drawbead for sheet metal forming analysis is experimentally verified in this paper. After the theoretical drawbead models improved a material description for the accurate calculation of drawbead forces are briefly introduced, they are verified by showing the good agreement of their drawbead forces with experimental measurements. Furthermore, the excellence of theoretical models is demonstrated by the comparison with those of commercial codes.

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Integrating Digital Technology into Elementary Mathematics: Three Theoretical Perspectives

  • Yeo, Sheunghyun
    • 한국수학교육학회지시리즈D:수학교육연구
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    • 제23권3호
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    • pp.165-179
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    • 2020
  • In this article, the author's intent is to begin a conversation centered on the question: How was the integration of digital technology into elementary mathematics classrooms framed? In the first part of the discussion, the author provides a historical perspective of the development of theoretical perspectives of the integration of digital technology in learning mathematics. Then, the author describes three theoretical perspectives of the role of digital technology in mathematics education: microworlds, instrumental genesis, and semiotic mediation. Last, based on three different theoretical perspectives, the author concludes the article by asking the reader to think differently.

이론 샘플링 검사의 실무적 한계 (Practical Limitations of Theoretical Acceptance Sampling)

  • 최성운
    • 대한안전경영과학회:학술대회논문집
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    • 대한안전경영과학회 2011년도 추계학술대회
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    • pp.205-211
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    • 2011
  • The papaer reviews four theoretical acceptance sampling plans as OC(Operating Characteristics) curve based inspection, rectifying inspection, switching inspection, and continuous inspection. In addition, the study presents practical limitations of theoretical acceptance sampling by attribute and by variable. Finally, following research also recommends the sampling inspection based on production technology. However, the inspection method requires quality expertise with various experience and implicit knowledge of the field.

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Iridium (III) quinoxaline 착물의 전자 구조, 인광 및 전기 발광 특성에 대한 DFT 및 시간-의존 DFT 연구 (DFT and Time-dependant DFT Investigation of eLectronic Structure, Phosphorescence and Electroluminescence Properties of Iridium (III) Quinoxaline Complexes)

  • Zhou, Xiao-Qing;Li, Ying;Sun, Yan-Bo;Zhang, Hong-Xing
    • 대한화학회지
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    • 제55권3호
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    • pp.354-363
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    • 2011
  • 3개의 적색 발광 Ir(III) 착물들인 $(fpmqx)_2Ir$(L) {fpmqx=2-(4-fluorophenyl)-3-methyl-quinoxaline; L=triazolylpyridine (trz) (1); L=picolinate (pic) (2) and L=acetylacetonate (acac) (3)}의 전자 구조, 흡수 및 인광 메커니즘, 전기 발광(EL) 특성을 양자화학적으로 연구하였다. 계산 결과에 따르면, 1의 HOMO는 강한 ${\eth}$-전자 받개 능력을 갖는 trz 부분에 편재되어 있으며, 2와 3의 HOMO는 Ir d-오비탈 과 페닐 고리 ${\pi}$-오비탈의 결합이라는 것을 나타내었다. 이 논문에서는 1-3사이의 인광 수득률과 차이에 대하여 연구하였으며, 1과 3보다 2의 EL 효율이 더 큰 이유를 합리적으로 설명하였다.