首页|化学气相沉积生长TaC涂层的高通量热力学分析

化学气相沉积生长TaC涂层的高通量热力学分析

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为指导半导体高温炉构件用高纯TaC涂层的生长调控,采用Thermo-calc软件开展TaC涂层生长过程的高通量热力学模拟计算,研究了沉积温度、压强和前驱体组分比对原料利用效率和TaC涂层纯度等指标的影响.模拟结果表明,在"TaCl5+C3H6+H2"体系中,X(Ta)∶ X(C)(摩尔分数比)决定了产物的物相组成,X(H)∶X(C)决定了高纯TaC涂层的形成窗口.当X(Ta)∶X(C)<1时,可以获得高质量TaC涂层,涂层中的主要杂质为游离碳,可以通过提高气氛中氢气的浓度来消除涂层中的游离碳杂质.根据模拟分析结果,推荐的反应窗口为:X(Ta)∶X(C)为 0.8~1.0 且X(H)∶X(C)≥400,沉积温度为 1 800~2 100 K,沉积压强为 5 000~10 000 Pa,可获得高纯度(>99%)和高原料利用率(>99%)的TaC涂层.
High-Throughput Thermodynamic Analysis of TaC Coatings by Chemical Vapor Deposition
For guiding the growth regulation of high-purity TaC coatings for semiconductor high-temperature furnace components,the high-throughput thermodynamic simulation calculation of TaC coating growth process was carried out by Thermo-calc software,and the effects of dep-osition temperature,pressure and precursor component ratio on raw material utilization efficiency and TaC coating purity were investigated.Sim-ulation results demonstrated that X(Ta)∶X(C)(Mole fraction ratio)determined the phase composition of the products,while X(H)∶X(C)defined the formation window of the high-purity TaC coating in the"TaCl5+C3H6+H2"system.When X(Ta)∶X(C)<1,high-quality TaC coatings could be obtained,and the free carbon was the primary impurity in the coating,which could be eliminated by elevating hydrogen con-centration in the atmosphere.According to the simulation analysis results,the recommended reaction window was X(Ta)∶X(C)of 0.8~1.0 and X(H)∶X(C)≥400,the deposition temperature of 1 800~2 100 K and deposition pressure of 5 000~10 000 Pa.Under the above condi-tions,the high purity(>99%)and high material utilization(>99%)TaC coatings could be obtained.

thermodynamicschemical processTaCdepositioncoatings

孙清云、陈辉、李士栋、张翅腾飞

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湖北隆中实验室,湖北襄阳 441000

中国机械总院集团武汉材料保护研究所有限公司,湖北武汉 430030

热力学 化学过程 TaC 沉积物 涂层

湖北省自然科学基金国家自然科学基金

2022CFB9362022CFB936

2024

材料保护
武汉材料保护研究所,中国腐蚀与防护学会 中国表面工程协会

材料保护

CSTPCD
影响因子:1.129
ISSN:1001-1560
年,卷(期):2024.57(4)
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