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熊谷 正芳*; 内田 知宏*; 村澤 皓大*; 高村 正人*; 池田 義雅*; 鈴木 裕士; 大竹 淑恵*; 浜 孝之*; 鈴木 進補*
Materials Research Proceedings, Vol.6, p.57 - 62, 2018/10
被引用回数：0 パーセンタイル：0.00(Metallurgy & Metallurgical Engineering)The convergence behavior of the parameters related to microstructural characteristics 
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was studied during optimizations in a common line profile analysis software program based on the convolutional multiple whole profile (CMWP) method. The weighted sums of squared residual (WSSR) was a criterion of the optimization. The parameters 
and 
, which are related to the dislocation density and to the crystallite size, respectively, strongly affect the line profile shape. Therefore, the distributions of WSSRs on the space parameters and were first observed. The variation trajectory of parameters and during iterative calculations with several values of parameter was then observed, along with the variations when all of the parameters were variable. In the case where only three parameters were variable, we found that a smaller initial value of should be chosen to ensure stability of the calculations. In the case where all parameters were variable, although all of the results converged to similar values, they did not precisely agree. To attain accurate optimum values, a two-step procedure is recommended.
村澤 皓大*; 高村 正人*; 熊谷 正芳*; 池田 義雅*; 鈴木 裕士; 大竹 淑恵*; 浜 孝之*; 鈴木 進補*
Materials Transactions, 59(7), p.1135 - 1141, 2018/07
被引用回数：8 パーセンタイル：37.03(Materials Science, Multidisciplinary)Neutron diffraction profile analysis using the whole profile fitting method is useful for obtaining microscopic information on metallic materials. To determine an appropriate fitting approach for obtaining reasonable and non-arbitrary results, we applied diffraction line profile analyses using the Convolutional Multiple Whole Profile (CMWP) method to diffraction patterns obtained using the Engineering Materials Diffractometer (TAKUMI, BL19) at the Materials and Life Science Facility (MLF) of the Japan Proton Accelerator Research Complex (J-PARC). The tensile specimens of 780 MPa grade bainitic steel were uniaxially stretched until the plastic strain reached a value of 0.05. We performed CMWP analyses on the obtained diffraction patterns during tensile test with various initial parameters of dislocation density and crystallite size. These parameters were optimized in the fitting procedures to minimize the weighted sums of squared residuals (WSSRs). Following this approach, we found that unsuitable initial parameter values resulted in unreasonable convergence. Therefore, initial fitting parameters should be chosen to ensure that the initial profiles are as broad as possible. Reasonable results were obtained following this suggestive approach even when the strain anisotropy parameter is set to arbitrary values.
