Diffusion of carbon in bcc Fe in the presence of Si

D. Simonovic; C. K. Ande; A. I. Duff; F. Syahputra; M. H. F. Sluiter

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Diffusion of carbon in bcc Fe in the presence of Si

机译：Si存在下，bcc Fe中碳的扩散

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The interaction of interstitial carbon with substitutional silicon and the effect of this interaction on the diffusion of carbon within body-centered-cubic iron, are computed using electronic density-functional theory. Both the activation energy for diffusion and the diffusion prefactor are predicted. Good agreement is found for those cases where a comparison with experimental data is possible.

机译：间隙碳与取代硅的相互作用以及这种相互作用对体心立方铁中碳扩散的影响，是使用电子密度泛函理论计算的。预测了扩散的活化能和扩散因子。对于可以与实验数据进行比较的情况，可以找到很好的一致性。

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来源
《Physical review》 |2010年第5期|p.054116.1-054116.8|共8页
作者
D. Simonovic; C. K. Ande; A. I. Duff; F. Syahputra; M. H. F. Sluiter;
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作者单位

Materials innovation institute (M2i), Mekelweg 2, 2628 CD Delft, The Netherlands;

Materials innovation institute (M2i), Mekelweg 2, 2628 CD Delft, The Netherlands;

Department of Material Science & Engineering, Delft University of Technology, Mekelweg 2, 2628 CD Delft, The Netherlands;

Department of Material Science & Engineering, Delft University of Technology, Mekelweg 2, 2628 CD Delft, The Netherlands;

Department of Material Science & Engineering, Delft University of Technology, Mekelweg 2, 2628 CD Delft, The Netherlands;

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正文语种 eng
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transition state theory and statistical theories of rate constants;

机译：过渡态理论和速率常数统计理论;

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2. STATISTICAL THEORY OF DIFFUSION IN CONCENTRATED BCC AND FCC ALLOYS AND CONCENTRATION DEPENDENCES OF DIFFUSION COEFFICIENTS IN BCC ALLOYS FeCu, FeMn, FeNi, AND FeCr [J] . V. G. Vaks, K. Yu. Khromov, I. R. Pankratov, Журнал экспериментальной и теоретической физики: Продолж. физ. части журнала Русского физико-хим. об-ва, издававшегося с 1873 по 1930 г. . 2016,第1期

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3. Simulation of atomic mobilities, diffusion coefficients and diffusion paths in bcc_A2 and bcc_B2 phases of the Al-Ni-Fe system [J] . Liu Dandan, Zhang Lijun, Du Yong, Journal of Alloys and Compounds: An Interdisciplinary Journal of Materials Science and Solid-state Chemistry and Physics . 2015,第Null期

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4. Simulation of the Diffusion Features of Point Defects in bcc Metals [C] . Andrey S. Chirkov, Andrei V. Nazarov International Conference on Diffusion in Solids: Past, Present and Future . 2006

机译：BCC金属点缺陷扩散特征的仿真
5. Effects of carbon on fracture mechanisms in nanocrystalline BCC iron: Atomistic simulations. [D] . Hyde, Brian. 2004

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6. Conjugate Channeling Effect in Dislocation Core Diffusion: Carbon Transport in Dislocated BCC Iron [O] . Akio Ishii, Ju Li, Shigenobu Ogata -1

机译：位错核心扩散中的共轭通道效应：BCC铁中碳的迁移
7. Diffusion of carbon in bcc Fe in the presence of Si [O] . Simonovic, D., Ande, C.K., Duff, A.I., 2010

机译：Si存在下，bcc Fe中碳的扩散

Diffusion of carbon in bcc Fe in the presence of Si

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