2006
DOI: 10.1016/j.actamat.2006.02.052
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Atomic-scale microstructures of Zr2Al3C4 and Zr3Al3C5 ceramics

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Cited by 64 publications
(51 citation statements)
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“…To compare these two crystal structures, theoretical structure optimizations were conducted using these two types of structure as input models. The calculated total energies are 25818.4489 eV for Ti 15 Al 6 C 9 (R3 _ m) and 17210.0654 eV for Ti 10 Al 4 C 6 (P6 3 /mmc), respectively. The latter crystal structure has a total energy of 25815.0981 eV when its formula is written in Ti 15 Al 6 C 9 , demonstrating that the crystal structure of the space group P6 3 /mmc is less stable.…”
Section: Resultsmentioning
confidence: 97%
See 1 more Smart Citation
“…To compare these two crystal structures, theoretical structure optimizations were conducted using these two types of structure as input models. The calculated total energies are 25818.4489 eV for Ti 15 Al 6 C 9 (R3 _ m) and 17210.0654 eV for Ti 10 Al 4 C 6 (P6 3 /mmc), respectively. The latter crystal structure has a total energy of 25815.0981 eV when its formula is written in Ti 15 Al 6 C 9 , demonstrating that the crystal structure of the space group P6 3 /mmc is less stable.…”
Section: Resultsmentioning
confidence: 97%
“…Gesing and Jeitschko [14] re-examined the composition and crystal structure of ZrAlC 1x using X-ray diffraction (XRD) technique and the space group was determined as P6 3 /mc and the composition was identified as Zr 3 Al 3 C 5 . Lin et al [15] using a combinational techniques of selected area electron diffraction (SAED) and convergent beam electron diffraction (CBED), determined the space group of both Zr 2 Al 3 C 4 and Zr 3 Al 3 C 5 as P6 3 /mmc. Similarly, more intensive studies are needed to understand the crystal structure of Ti 5 Al 2 C 3 , a new phase with complex structure in the Ti-Al-C system.…”
Section: Introductionmentioning
confidence: 99%
“…The Zr-Al-C carbides show great promise as ceramics of high hardness, strength, and toughness. They are also characterized as having high chemical stability, thermal stability, and strength at high temperature [8][9][10].…”
Section: Introductionmentioning
confidence: 99%
“…The nanolayered ternary ceramics M n+1 AX n , where M is an early transition metal, A is an element of IIIA or IVA, X is either C and/or N, and n = 1-3, possess a unique combination of the merits of both metals and ceramics: lightweight, readily machinable, elastically stiff, thermal and electrical conductive, thermal shock and hightemperature oxidation resistant, and damage tolerant [1][2][3][4][5][6][7][8][9].…”
Section: Introductionmentioning
confidence: 99%