• Title/Summary/Keyword: XRD Diffraction

Search Result 2,787, Processing Time 0.039 seconds

Development of Prediction Model for XRD Mineral Composition Using Machine Learning (기계학습을 활용한 XRD 광물 조성 예측 모델 개발)

  • Park Sun Young;Lee Kyungbook;Choi Jiyoung;Park Ju Young
    • Korean Journal of Mineralogy and Petrology
    • /
    • v.37 no.2
    • /
    • pp.23-34
    • /
    • 2024
  • It is essential to know the mineral composition of core samples to assess the possibility of gas hydrate (GH) in sediments. During the exploration of gas hydrates (GH), mineral composition values were obtained from each core sample collected in the Ulleung Basin using X-ray diffraction (XRD). Based on this data, machine learning was performed with 3100 input values representing XRD peak intensities and 12 output values representing mineral compositions. The 488 data points were divided into 307 training samples, 132 validation samples, and 49 test samples. The random forest (RF) algorithm was utilized to obtain results. The machine learning results, compared with expert-predicted mineral compositions, revealed a Mean Absolute Error (MAE) of 1.35%. To enhance the performance of the developed model, principal component analysis (PCA) was employed to extract the key features of XRD peaks, reducing the dimensionality of input data. Subsequent machine learning with the refined data resulted in a decreased MAE, reaching a maximum of 1.23%. Additionally, the efficiency of the learning process improved over time, as confirmed from a temporal perspective.

Zeolitification Characteristics of Coal Fly Ash by Amount of Na2CO3 Using the Fusion/Hydrothermal Method (용융/수열합성법으로부터 Na2CO3 첨가량에 따른 석탄비산재의 제올라이트화 특성)

  • Lee, Chang-Han
    • Journal of Environmental Science International
    • /
    • v.28 no.6
    • /
    • pp.553-559
    • /
    • 2019
  • In this study, zeolitic materials at $Na_2CO_3/CFA$ ratio of 0.6 - 1.8 were synthesized from coal fly ash from a thermal power plant using a fusion/hydrothermal method. The zeolitic materials were found to have cubic crystals structure and X-ray diffraction (XRD) peaks of Na-A zeolite by XRD and SEM analysis. When the zeolitic materials were synthesized from the coal fly ash, the XRD peaks of the zeolitic materials at $Na_2CO_3/CFA$ ratios of 0.9-1.8 had the same location as the XRD peaks of commercial Na-A zeolite. The XRD peaks of the Na-A zeolite ($Na_{12}Al_{12}Si_{12}O_{48}27.4H_2O$) were confirmed in the $2{\theta}$ in the range of 7.18-34.18. However, it was also confirmed that peaks of $CaCO_3$, an impurity inhibiting synthesis of Na-A zeolite from CaO and $Na_2CO_3$ in the coal fly ash, occurred in the XRD peaks of the zeolitic materials at $Na_2CO_3/CFA$ ratio of 1.5-1.8. The crystallinities of the zeolitic materials tended to increase gradually within the $Na_2CO_3/CFA$ ratio range of 0.6-1.8.

Asbestos Determination of Some Domestic Building-Materials Using X-ray diffraction (국내 건축자재에 함유된 석면의 함량에 대한 X-선회절분석 연구)

  • Hwang, Jin-Yeon;Lee, Hyo-Min;Oh, Ji-Ho;Park, Gi-Nam
    • Journal of the Mineralogical Society of Korea
    • /
    • v.24 no.2
    • /
    • pp.119-131
    • /
    • 2011
  • The asbestos contents in some representative building materials were analyzed using JIS (Japanese Industrial Standard) X-ray diffraction (XRD) method. The changes in mineral composition during analysis process and problems in JIS method were also examined. XRD analysis of some representative domestic building materials used for roof, wall, ceiling, and floor indicates that slate have the highest asbestos content having 6.87~6.93% of chrysotile. Other building materials analyzed in this study also have 1.35~3.98% of chrysotile contents. The XRD analysis results of asbestos contents in some domestic building materials are presented in this study. This method is very effective for the asbestos content evaluation of building materials according to newly modified asbestos content regulation (Law of Industrial Safety and Health, 2007-26) that limits asbestos content less than 0.1% by Ministry of Employment and Labor. Small amount of tremolite as well as chrysotile were also observed in some samples. With consideration of crystal shape, contents and geological occurrence, it is considered that tremolite is an associated mineral of chrysotile and is not intentionally added. Complemental analyses with optical microscope and SEM/EDS are also necessary because XRD method cannot distinguish asbestiform from non-asbestiform. The XRD method applied in this study is very effective in the asbestos content analysis of building materials, specially building materials showing high asbestos concentration in residues due to the high loss rate with ashing and acid dissolution procedure.

마이크로볼로미터를 위한 VOx-ZnO 다층 박막의 XRD 특성 연구

  • Mun, Su-Bin;Han, Seok-Man;Kim, Dae-Hyeon;Kim, Hyo-Jin;Sin, Jae-Cheol;Jang, Won-Geun;Han, Myeong-Su
    • Proceedings of the Korean Vacuum Society Conference
    • /
    • 2013.08a
    • /
    • pp.234-234
    • /
    • 2013
  • VOx 박막은 마이크로볼로미터 적외선 센서의 감지재료로 주로 사용된다. 일반적으로 VOx 박막은 RF sputtering 방법으로 증착이 되며, 이 때 저항 값은 수 kohm~수 Mohm, TCR 값은 -1.5~-2.0%/K까지 다양하게 변화되어 나타난다. 이는 산소의 phase가 여러가지로 변화되기 때문에 재현성이 떨어지는 단점이 있으며, 결정성있는 박막을 증착하기 어려운 문제들이 있다. 본 연구에서는 VOx 박막의 재현성 및 재료의 안정성을 위해 ZnO 물질을 첨가하여 sandwich 구조의 나노박막을 증착하여 산소 열처리를 통해 산소의 phase가 어떻게 변화되는가를 XRD 측정을 통해 조사하였다. ZnO 나노박막을 첨가함으로써 갓 증착되었을 때의 XRD는 V2O5 주된 상을 이루고 있었으며, 산소열처리에 의해 VO2상이 나타남을 알 수 있었다. 또한 V2O5 phase가 표면쪽의 얇은 층에서 주로 나타나고, 중간층은 V2O5와 VO2 phase 가 혼합된 형태로 존재함을 X-ray diffraction 분석을 통해 알 수 있었다. 또한 GIXRD 측정을 통해 깊이에 따른 혼합 phase가 주로 VO2에 의해 형성된 것임을 확인할 수 있었다. 또한 산소열처리의 온도 및 시간에 따라 XRD 특성을 조사하였으며, 최적의 열처리 조건을 XRD 피크를 통해 찾고자 하였다.

  • PDF

The application of a chemical assessment of archaeological animal bone by Fourier transform infrared spectroscopy and x-ray diffraction (FTIR과 XRD를 이용한 출토 동물뼈의 화학적 평가 적용)

  • Kang, Soyeong;Cho, Eun Min;Kim, Sue Hoon;Kim, Yun-Ji;Lee, Jeongwon
    • Analytical Science and Technology
    • /
    • v.27 no.6
    • /
    • pp.300-307
    • /
    • 2014
  • For the application of chemical assessment standards by the extent of diagenetic alteration, we investigated three archaeological animal bones and a modern animal bone using Fourier transform infrared-attenuated total reflection (FTIR-ATR) spectroscopy and x-ray diffraction (XRD) analysis. The calculating results of crystallinity index (CI), carbonate-to-phosphate (C/P) and carbonate-to-carbonate (C/C) using FTIR-ATR spectra showed differences CI and C/P according to the preservative condition of animal bones. By comparison of the crystallinity contents using XRD patterns, the states of animal bones were distinguished to the range of $30^{\circ}-35^{\circ}$. As results of FTIR-ATR and XRD analysis, it is suggested that Mongolian large mammals bone presents the best preservative condition, and cattle bone from Naju site, and Haman site followed. In addition, those were correlated with the results of histological index. The results suggested that the chemical assessment standards may contribute to application of predictions of the states of animal bones discovered from Korea.

Detail analysis of the peak disappearance of minor phase in mechanically alloyed samples(II) (기계적 합금화 시료에서 미소상 피이크의 소멸현상 해석(II))

  • Kim, Hye-Sung
    • Journal of the Korean Society of Industry Convergence
    • /
    • v.4 no.1
    • /
    • pp.27-34
    • /
    • 2001
  • Refining of powder particles and their dissolution into the Al matrix during mechanical alloying(MA) were investigated by using X-ray diffraction(XRD) transmission electron microscopy (TEM) functions of alloy composition, milling time and ball to powder ratio(BPR). It is found that Ti particles less than 20nm are observed in a dark field image of mechanically alloyed Al-10wt%Ti whose XHD pattern exhibits no Ti peak. The observed change of lattice constant of AI indicates that about 1 wt%Ti can he solved in Al after MA for a long time, independent of alloy composition, milling time and BPR, suggesting that most of Ti particles arc retained in the Al matrix. It is concluded that the disappearance of XRD peaks in mechanically alloyed Al-10wt%Ti is not simply attributable to the dissolution of Ti into Al, but associated mainly with extreme refining and/or heavy straining of Ti Particles.

  • PDF

Study on the Evaluation for the Property of Mo-Si Multilayers (Mo/Si 다층박막의 특성 평가에 관한 연구)

  • 허성민;김형준;이동현;이승윤;이영태
    • Journal of the Microelectronics and Packaging Society
    • /
    • v.8 no.2
    • /
    • pp.15-18
    • /
    • 2001
  • The Mo/si multilayer for EUV lithography was deposited using magnetron sputtering system. The multilayers were characterized using the cross-sectional transmission electron microscope (TEM) and low/high angle X-ray diffraction (XRD). The microstructure of Mo and Si was highly textured structure and amorphous, respectively. The well-defined low angle XRD peaks implies a well-defined multilayer structure. The interfacial layer of Mo-on-Si was thicker than Si-on-Mo interfacial layer.

  • PDF

XRD and Image Analyis of Low Carbon Type Recycled Cement Using Waste Concrete Powder (폐콘크리트 미분말을 이용하여 제조한 저탄소형 클링커의 XRD 및 영상분석)

  • Shin, Hyeon-Uk;Song, Hun;Chu, Yong-Sik;Lee, Jong-Kyu;Park, Dong-Cheon
    • Proceedings of the Korean Institute of Building Construction Conference
    • /
    • 2014.05a
    • /
    • pp.252-253
    • /
    • 2014
  • This study is to XRD and image analysis of low carbon type recycled cement from waste concrete powder and cement raw materials. Waste concrete powder possible to low carbon type recycled cement in small part of additive materials. Also, low carbon type recycled cement using waste concrete powder is suitable for ordinary portland cement.

  • PDF

Determination of temperature and flux variations during ultra-thin InGaN quantum well growth on a 2" wafer for GaN Green LED

  • Kim, Hyo-Jeong;Kim, Min-Ho;Jeong, Hun-Yeong;Lee, Hyeon-Hwi
    • Proceedings of the Korean Vacuum Society Conference
    • /
    • 2010.08a
    • /
    • pp.149-149
    • /
    • 2010
  • The origin of the inhomogeneous distribution of photoluminescence (PL) peak wavelength on a commercial 2" GaN wafer for green light emitting diode has been investigated by wide momentum transfer (Q) range x-ray diffraction (XRD) profile of InGaN/GaN multiple quantum wells. Near the GaN (0004) Bragg peak, wide-Q range XRD (${\Delta}Q$ > $1.4{\AA}-1$) was measured along the growth direction. Wide-Q XRD gives precise and direct information of ultra-thin InGaN quantum well structure. Based on the QW structural information, the variation of PL spectra can be explained by the combined effect of temperature gradient and slightly uneven flow of atomic sources during the QW growth. In narrow variations of indium composition and thickness of QW, an effective indium composition can be a good character to match structural data to PL spectra.

  • PDF

Activation energy for the loss of substitutional carbon in $Si_{0.984}C_{0.016}$ grown by solid phase epitaxy

  • Kim, Yong-Jeong;Kim, Tae-Joon;Park, Byungwoo;Song, Jong-Han
    • Journal of Korean Vacuum Science & Technology
    • /
    • v.4 no.2
    • /
    • pp.50-54
    • /
    • 2000
  • We studied the synthesis of S $i_{1-x}$ Cx (x=0.016) epitaxial layer using ion implantation and solid phase epitaxy (SPE). The activation energy Ea was obtained for the loss of substitutional carbon using fourier transform-infrared spectroscopy (FTIR) and high-resolution x-ray diffraction (HR-XRD). In FTIR analysis, the integrated peak intensity was used to quantify the loss of carbon atoms from substitutional to interstitial sites during annealing. The substitutional carbon contents in S $i_{0.984}$ $C_{0.016}$ were also measured using HR-XRD. By dynamic simulations of x-ray rocking curves, the fraction of substitutional carbon was obtained. The effects of annealing temperature and time were also studied by comparing vacuum furnace annealing with rapid thermal annealing (RTA))))))

  • PDF