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Nucleation kinetics, Williamson-Hall analysis, hardness and dielectric properties of pyridine-2-carboxylictrichloroacetate single crystals
Physica B: Condensed Matter ( IF 2.8 ) Pub Date : 2021-09-09 , DOI: 10.1016/j.physb.2021.413397
N. Manopradha 1, 2 , S. Gowri 1 , S. Rama 3 , K. Selvaraju 2 , K. Kirubavathi 2
Affiliation  

The single crystals of pyridine-2-carboxylictrichloroacetate (P2CT) were synthesized using standard method at room temperature. Nucleation parameters such as, radius of critical nucleus, nucleation rate, and interfacial and volume free energy has been estimated. The solubility of the crystal at different temperatures is analyzed. Thermodynamic parameters from vibration analysis are compared with the enthalpy obtained from solubility to predict the stability of the crystal. X-ray diffraction investigating the structural aspects establishes the crystal structure belonging to crystal system as monoclinic nature. Williamson–Hall approach assesses the structural characteristics of the grown crystal: average crystallite size along with lattice strain. In between 220 and 1000 nm wavelength range, the optical absorption spectra of P2CT are recorded. Based on derivation of absorption spectrum fitting method, optical energy band gap and nature of optical transitions in the crystal is determined. Vickers microhardness test estimates the hardness parameters and elastic stiffness is evaluated through Wooster's empirical relation.



中文翻译:

吡啶-2-羧基三氯乙酸酯单晶的成核动力学、威廉姆森-霍尔分析、硬度和介电性能

使用标准方法在室温下合成吡啶-2-羧基三氯乙酸酯(P2CT)的单晶。已经估计了成核参数,例如临界核半径、成核速率以及界面和体积自由能。分析了晶体在不同温度下的溶解度。将来自振动分析的热力学参数与从溶解度获得的焓进行比较,以预测晶体的稳定性。研究结构方面的 X 射线衍射确定了属于单斜晶系的晶体结构。Williamson-Hall 方法评估生长晶体的结构特征:平均微晶尺寸和晶格应变。在 220 到 1000 nm 波长范围内,记录了 P2CT 的光吸收光谱。基于吸收光谱拟合方法的推导,确定了晶体中的光学能带隙和光学跃迁的性质。维氏显微硬度测试估计硬度参数和弹性刚度是通过伍斯特的经验关系评估的。

更新日期:2021-09-27
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