Complex Assessment of X-ray Diffraction in Crystals with Face-Centered Silicon Carbide Lattice

Author:

Bosikov Igor I.1,Martyushev Nikita V.2ORCID,Klyuev Roman V.3ORCID,Tynchenko Vadim S.456ORCID,Kukartsev Viktor A.7,Eremeeva Svetlana V.8,Karlina Antonina I.9ORCID

Affiliation:

1. Department of Information Technologies and Systems, North Caucasian Institute of Mining and Metallurgy (State Technological University), 44, Nikolaev Str., 362011 Vladikavkaz, Russia

2. Department of Advanced Technologies, Tomsk Polytechnic University, 30, Lenin Ave., 634050 Tomsk, Russia

3. Technique and Technology of Mining and Oil and Gas Production Department, Moscow Polytechnic University, 33, B. Semenovskaya Str., 107023 Moscow, Russia

4. Department of Technological Machines and Equipment of Oil and Gas Complex, School of Petroleum and Natural Gas Engineering, Siberian Federal University, 660041 Krasnoyarsk, Russia

5. Information-Control Systems Department, Institute of Computer Science and Telecommunications, Reshetnev Siberian State University of Science and Technology, 660037 Krasnoyarsk, Russia

6. Digital Material Science: New Materials and Technologies, Bauman Moscow State Technical University, 105005 Moscow, Russia

7. Department of Materials Science and Materials Processing Technology, Polytechnical Institute, Siberian Federal University, 660041 Krasnoyarsk, Russia

8. Laboratory of Biofuel Compositions, Siberian Federal University, 660041 Krasnoyarsk, Russia

9. Research and testing center "MGSU STROY-TEST", Moscow State University of Civil Engineering, 107023 Moscow, Russia

Abstract

X-ray diffraction analysis is essential in studying stacking faults. Most of the techniques used for this purpose are based on theoretical studies. These studies suggest that the observed diffraction patterns are caused by random stacking faults in crystals. In reality, however, the condition of randomness for stacking faults may be violated. The purpose of the study was to develop a technique that can be used to calculate the diffraction effects of the axis of the thin plates of twin, new phases, as well as other variations in defective structures. Materials and methods. This was achieved through modern X-ray diffraction methods using differential equations (transformations and Fourier transforms) and the construction of the Ewald sphere, mathematical analysis, mathematical logic, and mathematical modeling (complex Markov chain). Conclusion. The study made it possible to develop a technique for the calculation of the diffraction effects of the axis of the thin plates of twin, new phases and other variations in defective structures. The technique makes it possible to solve several complex, urgent problems related to the calculation of X-ray diffraction for crystals with face-centered lattices containing different types of stacking faults. At the same time, special attention was paid to the correlations between the relative positions of faults. The calculations showed that the proposed method can help to determine the nature and structure of stacking faults by identifying the partial and vertex dislocations limiting them in twin crystals with a face-centered cubic structure of silicon carbide based on X-ray diffraction analysis.

Publisher

MDPI AG

Subject

Inorganic Chemistry,Condensed Matter Physics,General Materials Science,General Chemical Engineering

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