Uniaxial Negative Thermal Expansion and Mechanism in Zn（NCN）

doi:10.7503/cjcu20220124

Chem. J. Chinese Universities ›› 2022, Vol. 43 ›› Issue (6): 20220124.doi: 10.7503/cjcu20220124

• Physical Chemistry • Previous Articles Next Articles

Uniaxial Negative Thermal Expansion and Mechanism in Zn（NCN）

SHI Naike¹, ZHANG Ya¹, SANSON Andrea², WANG Lei³, CHEN Jun¹()

^1.Beijing Advanced Innovation Center for Materials Genome Engineering，Department of Physical Chemistry，University of Science and Technology Beijing，Beijing 100083，China
^2.Department of Physics and Astronomy，University of Padova，Padova I? 35131，Italy
^3.Department of Physics，University of Science and Technology Beijing，Beijing 100083，China

Received:2022-03-01 Online:2022-06-10 Published:2022-04-11
Contact: CHEN Jun E-mail:junchen@ustb.edu.cn
Supported by:
the National Natural Science Foundation of China(22101020);the Fundamental Research Funds for the Central Universities, China(20-041A2)

Abstract

Abstract:

As an abnormal physical phenomenon， negative thermal expansion（NTE） has been observed in some materials like alloys and framework structure materials. However， the types of NTE materials are still limited. In this study， a uniaxial NTE material Zn（NCN） was synthesized. The coefficient of thermal expansion of the c-axis is -3.35×10^?6 K^?1 of 100—475 K， while the a and b axes show low thermal expansion. The volume of Zn（NCN） has a low coefficient of thermal expansion（α_vca. 6.13×10^?6 K^?1， 100—475 K）. The NTE mechanism was revealed by joined methods of synchrotron X-ray diffraction， extended X-ray absorption fine structure spectroscopy， and Raman spectra. It is found that the Zn—N exhibits obvious transverse vibration. Some low frequency vibration modes show negative Grüneisen parameter. The direct experimental evidence reveals that the transverse vibration of N=C=N linkage and coupling rotation and twist of quasi rigid ZnN₄ tetrahedra result in the NTE in the c-axis.

Key words: Negative thermal expansion, Framework structure, Crystal structure, Zinc cyanamide, Transverse vibration

CLC Number:

O641

TrendMD:

SHI Naike, ZHANG Ya, SANSON Andrea, WANG Lei, CHEN Jun. Uniaxial Negative Thermal Expansion and Mechanism in Zn（NCN）[J]. Chem. J. Chinese Universities, 2022, 43(6): 20220124.

Figures/Tables 5

References 18

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Uniaxial Negative Thermal Expansion and Mechanism in Zn（NCN）

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