Structural, electronic and elastic properties of MAX phases M2GaN (M = Ti, V and Cr)

Solid State Sciences

Volumn 11, Issue 11, 2009, Pages 1875-1881

  Bouhemadou, A ^a  

^a FERHAT ABBAS UNIVERSITY   (Algeria)

Author keywords

Ab initio; Elastic properties; Electronic structure; MAX phases; Structural properties

Indexed keywords

AB INITIO; BULK MODULUS; DENSITY OF STATE; ELASTIC PROPERTIES; ELECTRICAL CONDUCTORS; EXPERIMENTAL CONFIRMATION; EXPERIMENTAL DATA; FINITE STRAIN; FIRST-PRINCIPLES; GEOMETRICAL PARAMETERS; INTERNAL COORDINATES; MAX PHASES; MAX PHASIS; POISSON'S RATIO; POLYCRYSTALLINE; SHEAR MODULUS; SOUND VELOCITIES; THEORETICAL PREDICTION; TOTAL ENERGY CALCULATION; UNIT CELL LENGTH; VALENCE ELECTRON CONCENTRATION; YOUNG'S MODULUS; ZERO PRESSURE;

CELL MEMBRANES; CHROMIUM; ELASTIC CONSTANTS; ELASTIC MODULI; ELASTICITY; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; GALLIUM ALLOYS; GALLIUM NITRIDE; LATTICE CONSTANTS; POISSON RATIO; SEMICONDUCTING GALLIUM; TRANSITION METALS;

STRUCTURAL PROPERTIES;

EID: 70350573348     PISSN: 12932558     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.solidstatesciences.2009.08.002     Document Type: Article

References (58)

1. Barsoum M.W., and El-Raghy T. J. Am. Ceram. Soc. 79 (1996) 1953
2. Barsoum M.W., and El-Raghy T. J. Mater. Synth. Process. 5 (1997) 197
3. Zhou Y.C., and Sun Z.M. Mater. Res. Innovations 2 (1999) 360
4. Barsoum M.W. Prog. Solid State Chem. 28 (2000) 201
5. Barsoum M.W., and Radovic M. Mechanical Properties of the MAX Phases, Encyclopedia of Materials: Science and Technology (2004), Elsevier, Amsterdam
6. Barsoum M.W. Physical Properties of the MAX Phases, Encyclopedia of Materials: Science and Technology (2006), Elsevier, Amsterdam
7. Zhou Y.C., and Sun Z.M. Phys. Rev. B 61 (2000) 12570
8. Hug G., and Fries E. Phys. Rev. B 65 (2002) 113104
9. Sun Z., Ahuja R., and Schneider J.M. Phys. Rev. B 68 (2003) 224112
10. Sun Z., Ahuja R., Li S., and Schneider J.M. Appl. Phys. Lett. 83 (2003) 899
11. Wang J.Y., and Zhou Y.C. Phys. Rev. B 69 (2004) 214111
12. Sun Z., Music D., Ahuja R., Li S., and Schneider J.M. Phys. Rev. B 70 (2004) 508
13. Sun Z., Li S., Ahuja R., and Schneider J.M. Solid State Commun. 129 (2004) 589
14. Wang J.Y., and Zhou Y.C. J. Phys. Condens. Mater. 16 (2004) 2819
15. Lofland S.E., Hettinger J.D., Harrel K., Finkel P., Gupta S., Barsoum M.W., and Hug G. Appl. Phys. Lett. 84 (2004) 508
16. Sun Z., Music D., Ahuja R., and Schneider J.M. J. Phys. Condens. Mater. 17 (2005) 7169
17. Schneider J.M., Music D., and Sun Z. J. Appl. Phys. 97 (2005) 066105
18. Sun Z., Music D., Ahuja R., Li S., and Schneider J.M. Phys. Rev. B 71 (2005) 193402
19. Hettinger J.D., Lofland S.E., Finkel P., Meehan T., Palma J., Harrel K., Gupta S., Ganguly A., El-Raghy T., and Barsoum M.W. Phys. Rev. B 72 (2005) 115120
20. Hug G., Jaouen M., and Barsoum M.W. Phys. Rev. B 71 (2005) 024105
21. Kumar R.S., Rekhi S., Cornelius A.L., and Barsoum M.W. App. Phys. Lett. 86 (2005) 111904
22. Hug G., Jaouan M., and Barsoum M.W. Phys. Rev. B 71 (2005) 024105
23. Music D., Sun Z., and Scheider J.M. Solid State Commun. 133 (2005) 381
24. Manoun B., Gulve R.P., Saxena S.K., Gupta S., Barsoum M.W., and Zha C.S. Phys. Rev. B 73 (2006) 024110
25. Sun Z., Music D., Anddrey A., Voevodin A., and Schneider J.M. Solid State Commun. 139 (2006) 139
26. Hug G. Phys. Rev. B 74 (2006) 184113
27. Bouhemadou A., and Khenata R. J. Appl. Phys. 102 (2007) 043528
28. Emmerlich J., Music D., Houben A., Dronkowski R., and Schneider J.M. Phys. Rev. B 6 (2007) 224111
29. Bouhemadou A., Khenata R., and Chegaar M. Eur. Phys. J. B 56 (2007) 209
30. Bouhemadou A. Mod. Phys. Lett. B 22 (2008) 2063
31. Bouhemadou A. High Pressure Res. 28 (2008) 45
32. Bouhemadou A. Physica B 403 (2008) 2707
33. Bouhemadou A., Khenata R., Kharoubi M., and Medkour Y. Solid State Commun. 146 (2008) 175
34. Bouhemadou A., and Khenata R. Phys. Lett. A 372 (2008) 6448
35. Hohenberg P., and Kohn W. Phys. Rev. 136 (1964) 86
36. Kohn W., and Sham L.J. Phys. Rev. A 140 (1965) 1133
37. Segall M.D., Lindan P.L.D., Probert M.J., Pickard C.J., Hasnip P.J., Clark S.J., and Payne M.C. J. Phys. Condens. Mater. 14 (2002) 2717
38. Ceperly D.M., and Alder B.J. Phys. Rev. Lett. 45 (1980) 566
39. Perdew J.P., and Zunger A. Phys. Rev. B 23 (1981) 5048
40. Perdew J.P., Burke K., and Ernzerhof M. Phys. Rev. Lett. 77 (1996) 3865
41. Vanderbilt D. Phys. Rev. B 41 (1990) 7892
42. Monkhorst H.J., and Pack J.D. Phys. Rev. B 13 (1976) 5188
43. Fischer T.H., and Almlof J. J. Phys. Chem. 96 (1992) 9768
44. Milman V., Winkler B., and Probert M.I.J. J. Phys. Condens. Mater. 17 (2005) 2233
45. Birch F. J. Geophys. Res. 83 (1978) 1257
46. Barsoum M.W., Goldczewski J., Seifert H., and Aldinger F. J. Alloys Compd. 340 (2002) 173
47. Barsoum M.W., Salama I., El-Raghy T., Goldczewski J., Porter W.D., Wang H., Seifert H., and Aldinger F. Metall. Mater. Trans. A 33 (2002) 2775
48. Barsoum M.W., Ali M., and El-Raghy T. Metall. Mater. Trans. A 31 (2000) 1857
49. Pugh S.F. Philos. Mag. 45 (1954) 823
50. Mehl M.J., Klein B.M., and Papaconstantopoulos D.A. Intermetallic Compounds: Principle and Practice. In: Westbrook J.H., and Fleischeir R.L. (Eds). Principles vol. I (1995), John Wiley and Sons, London
51. Reuss A. Z. Angew. Math. Mech. 8 (1929) 55
52. Voigt W. Lehrbush der Kristallphysik (1928), Taubner, Leipzig
53. Hill R. Proc. Phys. Soc. Lond. A 65 (1952) 349
54. Schreiber E., Anderson O.L., and Soga N. Elastic Constants and Their Measurements (1973), McGraw-Hill, New York
55. Jhi S.H., Ihm J., Louie S.G., and Cohen M.L. Nature 399 (1999) 132
56. Anderson O.L. J. Phys. Chem. Solids 24 (1963) 909
57. Drulis M.K., Drulis H., Gupta S., Barsoum M.W., and El-Raghy T. J. Appl. Phys. 99 (2006) 093502
58. Drulis M.K., Drulis H., Hachemer A.E., Ganguly A., El-Raghy T., and Barsoum M.W. J. Alloys Compd. 433 (2007) 59