• Journal of Inorganic Materials
  • Vol. 35, Issue 1, 35 (2020)
Lei-Lei CHEN1, Zi-Xuan DENG1, Mian LI1, Peng LI1, Ke-Ke CHANG1、2、*, Feng HUANG1, Shi-Yu DU1, and Qing HUANG1
Author Affiliations
  • 1Engineering Laboratory of Advanced Energy Materials, Ningbo Institute of Industrial Technology, Chinese Academy of Sciences, Ningbo 315201, China
  • 2Center of Materials Science and Optoelectronics Engineering, University of Chinese Academy of Sciences, Beijing 100049, China
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    DOI: 10.15541/jim20190184 Cite this Article
    Lei-Lei CHEN, Zi-Xuan DENG, Mian LI, Peng LI, Ke-Ke CHANG, Feng HUANG, Shi-Yu DU, Qing HUANG. Phase Diagrams of Novel MAX Phases[J]. Journal of Inorganic Materials, 2020, 35(1): 35 Copy Citation Text show less

    Abstract

    Phase diagrams are used as an indicator to estimate the thermodynamic stabilities of the novel MAX phases (Ti3AuC2, Ti3IrC2, Ti3ZnC2, Ti2ZnC). The phase diagrams of the Ti-Au-C, Ti-Ir-C, and Ti-Zn-C systems were obtained using the CALPHAD (Calculation of Phase Diagrams) approach coupled with ab initio calculations. The calculated results confirmed thermodynamic stabilities of the synthesized Ti3AuC2, Ti3IrC2, Ti3ZnC2, and Ti2ZnC MAX phases, which is in great agreement with the experiment information. The present work shows a systematic method to calculate the thermodynamic stability of the novel MAX phases, which can be used as guidance to synthesize more undiscovered MAX phases.
    Lei-Lei CHEN, Zi-Xuan DENG, Mian LI, Peng LI, Ke-Ke CHANG, Feng HUANG, Shi-Yu DU, Qing HUANG. Phase Diagrams of Novel MAX Phases[J]. Journal of Inorganic Materials, 2020, 35(1): 35
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