Anisotropy in electronic, optical, and mechanical properties of superhard body-centered tetragonal C4 phase of carbon

Applied Physics Letters

Volumn 97, Issue 6, 2010, Pages

  Wei, P Y ^a   Sun, Y ^a   Chen, X Q ^a   Li, D Z ^a   Li, Y Y ^a  

^a INSTITUTE OF METAL RESEARCH   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION EDGES; ADSORPTION SPECTRUM; AMBIENT PRESSURES; ANISOTROPIC FEATURES; CARBON CHAINS; DIRECTIONAL DISTRIBUTIONS; ELECTRONIC ANISOTROPY; HYBRID DENSITY FUNCTIONAL THEORY; IN-PLANE; OUT-OF-PLANE; OUT-OF-PLANE COMPONENTS; SUPERHARD; VALENCE ELECTRON;

ADSORPTION; ANISOTROPY; DENSITY (SPECIFIC GRAVITY); DENSITY FUNCTIONAL THEORY; ORGANIC POLYMERS;

MECHANICAL PROPERTIES;

EID: 77955752175     PISSN: 00036951     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3479478     Document Type: Article

References (15)

1. A. H. Castro Neto, F. Guinea, N. M. R. Peres, K. S. Novoselov, and A. K. Geim, Rev. Mod. Phys. RMPHAT 0034-6861 81, 109 (2009). 10.1103/RevModPhys.81.109
2. X. -Q. Chen, C. L. Fu, and C. Franchini, J. Phys.: Condens. Matter JCOMEL 0953-8984 22, 292201 (2010). 10.1088/0953-8984/22/29/292201
3. W. L. Mao, M. Ho-kwang, P. J. Eng, T. P. Trainor, M. Newville, K. Chi-chang, D. L. Heinz, J. Shu, Y. Meng, and R. J. Hemley, Science SCIEAS 0036-8075 302, 425 (2003). 10.1126/science.1089713 (Pubitemid 37296263)
4. F. J. Ribeiro, P. Tangney, S. G. Louie, and M. L. Cohen, Phys. Rev. B PLRBAQ 0556-2805 72, 214109 (2005). 10.1103/PhysRevB.72.214109 (Pubitemid 43029296)
5. Q. Li, Y. Ma, A. R. Oganov, H. Wang, H. Wang, Y. Xu, T. Cui, H. -K. Mao, and G. Zou, Phys. Rev. Lett. PRLTAO 0031-9007 102, 175506 (2009). 10.1103/PhysRevLett.102.175506
6. K. Umemoto, R. M. Wentzcovitch, S. Saito, and T. Miyake, Phys. Rev. Lett. PRLTAO 0031-9007 104, 125504 (2010). 10.1103/PhysRevLett.104.125504
7. Y. Omata, Y. Yamagami, K. Tadano, T. Miyake, and S. Saito, Physica (Amsterdam) PELNFM 1386-9477 29E, 454 (2005).
8. A. D. Becke, J. Chem. Phys. JCPSA6 0021-9606 98, 1372 (1993). 10.1063/1.464304
9. A. V. Krukau, O. A. Vydrov, A. F. Izmaylov, and G. E. Scuseria, J. Chem. Phys. JCPSA6 0021-9606 125, 224106 (2006). 10.1063/1.2404663 (Pubitemid 44927407)
10. G. Kresse and J. Hafner, Phys. Rev. B PLRBAQ 0556-2805 48, 13115 (1993). 10.1103/PhysRevB.48.13115
11. G. Kresse and J. Furthmuller, Comput. Mater. Sci. CMMSEM 0927-0256 6, 15 (1996). 10.1016/0927-0256(96)00008-0 (Pubitemid 126412269)
12. J. Paier, R. Hirschl, M. Marsman, and G. Kresse, J. Chem. Phys. JCPSA6 0021-9606 122, 234102 (2005). 10.1063/1.1926272 (Pubitemid 41100390)
13. J. Heyd, G. E. Scuseria, and M. Ernzerhof, J. Chem. Phys. JCPSA6 0021-9606 118, 8207 (2003). 10.1063/1.1564060
14. M. Gajdoš, K. Hummer, and G. Kresse, Phys. Rev. B PLRBAQ 0556-2805 73, 045112 (2006). 10.1103/PhysRevB.73.045112 (Pubitemid 43270689)
15. J. Haines, J. M. Ĺger, and G. Bocquillon, Annu. Rev. Mater. Res. ARMRCU 1531-7331 31, 1 (2001). 10.1146/annurev.matsci.31.1.1 (Pubitemid 33073844)