Morphological evolution of TiC from octahedron to cube induced by elemental nickel†

IF 2.6 3区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY
CrystEngComm Pub Date : 2012-01-20 DOI:10.1039/C1CE06205K
Jinfeng Nie, Yuying Wu, Pengting Li, Hui Li and Xiangfa Liu
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引用次数: 58

Abstract

TiC particles with various morphologies from octahedron to cube were synthesized and investigated by Field emission scanning electron microscopy (FESEM) in three-dimensional space. The morphological evolution of TiC grain and its growth mechanism were also discussed. TiC particles prefer an octahedral morphology (equilibrium shape) enclosed by eight {111} facets with minimized total surface free energy in Al–Ti–C alloy, while they tend to form a cube enclosed by six {100} facets under the influence of Ni in Al–Ni–Ti–C alloy. Due to the strong interaction between Ni–3d and C–2p orbitals, Ni atoms in the melt selectively absorb on {100} faces of the growing TiC crystal rather than on the polar {111} faces and reduce the specific surface energy of {100}. According to Wuff's theorem, the growth rate of {100} is lowered correspondingly, while the relative growth rate of {111} is accelerated. Thus, the higher growth rate along <111> direction will lead to the shrinkage of {111} faces gradually, while six {100} faces are reserved to form a TiC cube because of their lower growth rates. Furthermore, a similar morphology evolution to TiC crystals can also be found in Fe- and Co-containing melts. It is revealed that the crystal growth of TiC follows the same model under the effect of group VIII elements (Fe, Co and Ni).

Abstract Image

单质镍†诱导TiC从八面体到立方体的形态演变
利用场发射扫描电镜(FESEM)在三维空间中合成了从八面体到立方体的不同形态的TiC颗粒。讨论了TiC晶粒的形态演变及其生长机理。在Al-Ni-Ti-C合金中,TiC颗粒在总表面自由能最小的情况下倾向于形成由8个{111}面包围的八面体(平衡形状),而在Al-Ni-Ti-C合金中,TiC颗粒在Ni的影响下倾向于形成由6个{100}面包围的立方体。由于Ni - 3d和C-2p轨道之间的强相互作用,熔体中的Ni原子选择性地吸收生长的TiC晶体的{100}面而不是极性{111}面,从而降低了{100}的比表面能。根据Wuff定理,{100}的增长率相应降低,而{111}的相对增长率则加快。因此,沿<111>{111}面逐渐收缩,而{100}面由于生长速率较低,保留6个面形成TiC立方体。此外,在含铁和含钴熔体中也可以发现与TiC晶体相似的形貌演变。结果表明,在Fe、Co、Ni等VIII族元素的作用下,TiC的晶体生长遵循相同的模式。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
CrystEngComm
CrystEngComm 化学-化学综合
CiteScore
5.50
自引率
9.70%
发文量
747
审稿时长
1.7 months
期刊介绍: Design and understanding of solid-state and crystalline materials
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