Atomic and electronic structures of a-SiC:H from tight-binding molecular dynamics

Journal of Physics Condensed Matter

Volumn 15, Issue 24, 2003, Pages 4119-4126

  Ivashchenko, V I ^a   Turchi, P E A ^b   Shevchenko, V I ^a   Ivashchenko, L A ^a   Rusakov, G V ^a  

^a FRANTSEVICH INSTITUTE FOR PROBLEMS OF MATERIALS SCIENCE   (Ukraine)

^b LAWRENCE LIVERMORE NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ANNEALING; COMPUTER SIMULATION; CONDENSATION; COOLING; ELECTRONIC STRUCTURE; HYDROGENATION; MOLECULAR DYNAMICS; PASSIVATION;

COLOR SENSORS;

SILICON CARBIDE;

EID: 0038573973     PISSN: 09538984     EISSN: None     Source Type: Journal    
DOI: 10.1088/0953-8984/15/24/305     Document Type: Article

References (22)

1. Bullot J and Schmidt M P 1987 Phys. Status Solidi b 143 346
2. Hamakawa Y 1998 Renew. Energy 15 22
3. Calcagno L, Martins R, Hallen A and Skorupa W (ed) 2001 Amorphous and Microcrystalline Silicon Carbide: Materials and Applications vol 112 (Amsterdam: European Materials Research Society)
4. Finocchi F, Galli G, Parrinello M and Bertoni C M 1992 Phys. Rev. Lett. 68 3044
5. Kelires P C 1992 Phys. Rev. B 46 10048
6. Demichelis F, Giorgis F, Pirri C F and Tresso E 1996 Physica B 225 103
7. Desalvo A, Giorgis F, Pirri C F, Tresso E, Rava P, Galloni R, Rizzoli R and Summonte C 1997 J. Appl. Phys. 81 7973
8. Magafas L 1998 J. Non-Cryst Solids 238 158
9. Ivashchenko V I, Shevchenko V I, Rusakov G V, Klymenko A S, Popov V M, Ivashchenko L A and Bogdanov E I 2002 J. Phys.: Condens. Matter 14 1799
10. Ivashchenko V I, Turchi P E A, Shevchenko V I, Ivashchenko L A and Rusakov G V 2002 Phys. Rev. B 66 195201
11. Vogl P, Hjalmarson H J and Dow J D 1983 J. Phys. Chem. Solids 44 365
12. Molteni C, Colombo L and Miglio L 1994 Phys. Rev. B 50 4371
13. Bockstedte M, Kley A, Neugebauer J and Scheffer M 1997 Comput. Phys. Commun. 107 187
14. Allen W D and Schaefer H F 1986 Chem. Phys. 108 243
15. Johnson B G, Gill P M W and Pople J A 1993 J. Chem. Phys. 98 5612
16. Robertson J 1992 Phil. Mag. B 66 615
17. Winn M D, Rassinger M and Hafner J 1997 Phys. Rev. B 55 5364
18. Buda F, Chiarotti G L, Car R and Parrinello M 1991 Phys. Rev. B 44 5908
19. Klein P, Urbassek H M and Frauenheim Th 1999 Phys. Rev. B 60 5478
20. Godwin P D, HorsfiIeld A P, Stoneham A M, Bull S J, Ford I J, Harker A H, Pettifor D G and Sutton A P 1996 Phys. Rev. B 54 15785
21. Haydock R, Heine V and Kelly M J 1972 J. Phys. C: Solid State Phys. 5 2845
22. Nex C M M 1984 Comput. Phys. Commun. 43 101