Phase tree, analysis of crystallizing phases and description of chemical interaction in the three-component reciprocal system Ca,Ba| |F,Cl

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Abstract

The paper analyzes the crystallizing phases in the ternary reciprocal system Ca,Ba | | F,Cl, describes the chemical interaction of ion exchange reactions and complexation reactions. The system is partitioned into simplices using graph theory. A tree of phases of the system has been constructed, on the basis of which a prediction of the number and composition of crystallizing phases in stable elements has been made. A 3D model of the phase complex of the Ca,Ba | | F,Cl system was built using the KOMPAS 3D v21 software. On the stable CaF2–BaCl2 diagonal, the presence of a quasi-binary eutectic and the stability of the crystallizing phases were confirmed by thermogravimetry and XRD methods.

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About the authors

T. D. Slavnov

Samara State Technical University

Email: dvoryanova_kat@mail.ru
Russian Federation, Samara

E. M. Egorova

Samara State Technical University

Author for correspondence.
Email: dvoryanova_kat@mail.ru
Russian Federation, Samara

I. K. Garkushin

Samara State Technical University

Email: dvoryanova_kat@mail.ru
Russian Federation, Samara

A. V. Burchakov

Samara State Technical University

Email: dvoryanova_kat@mail.ru
Russian Federation, Samara

M. A. Demina

Samara State Technical University

Email: dvoryanova_kat@mail.ru
Russian Federation, Samara

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Supplementary files

Supplementary Files
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1. JATS XML
2. Fig. 1. Development of the T–x–y diagram of the three-component reciprocal system Ca,Ba| |F,Cl and T–x diagrams of double faceting systems. *—predicted value.

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3. Fig. 2. Projection of the liquidus onto the square of the compositions of the three-component reciprocal system Ca,Ba||F,Cl. *—predicted value.

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4. Fig. 3. 3D model of the phase complex of the Ca,Ba| |F,Cl. *—predicted value.

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5. Fig. 4. Isothermal sections of the system Ca,Ba| |F,Cl at 1200, 1000, 900 and 700 °C obtained from the model.

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6. Fig. 5. Isothermal sections of the Ca,Ba system | | F,Cl at 800, 750, 650 and 600 °C obtained from the model.

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7. Fig. 6. Polythermal section of the unstable diagonal BaF2—CaCl2 of the Ca,Ba| |F,Cl obtained from the model.

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8. Fig. 7. Polythermal section of the secant CaBaCl4–CaFCl system Ca,Ba | | F,Cl obtained from the model.

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9. Fig. 8. Derivatograms of heating and cooling of a sample of composition  (CaF2 - 25%, BaF2 - 15%, BaCl2 - 60%).

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10. Fig. 9. Derivatograms of heating and cooling of a sample of composition  (CaF2 - 10%, BaF2 - 30%, BaCl2 - 60%).

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11. Fig. 10. X-ray diffraction pattern of a sample with the composition 22.5% CaF2 + 77.5% BaCl2 (CaF2 PDF 00-002-1302; BaCl2 PDF 01-072-0368).

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