Theoretical study of aromaticity in inorganic tetramer clusters

Journal of Chemical Sciences

Volumn 118, Issue 6, 2006, Pages 575-578

  Nigam, Sandeep ^a   Majumder, Chiranjib ^a   Kulshreshtha, S K ^a  

^a BHABHA ATOMIC RESEARCH CENTRE   (India)

Author keywords

Aromaticity; Density functional theory; Inorganic tetramer clusters

Indexed keywords

AROMATIC PROPERTIES; AROMATICITY; INORGANIC TETRAMER CLUSTERS; PLANAR STRUCTURE;

ELECTRONIC STRUCTURE; GROUND STATE; NEGATIVE IONS; PROBABILITY DENSITY FUNCTION;

INORGANIC COMPOUNDS;

EID: 33846020981     PISSN: 02534134     EISSN: None     Source Type: Journal    
DOI: 10.1007/BF02703955     Document Type: Conference Paper

References (40)

1. Li X, Kuznetsov AK, Hai-Feng H, Zhang, Boldyrev A I and Wang L 2001 Science 291
2. Shetty S, Kanhere DG and Pal S 2004 J. Phys. Chem. A108 628
3. Kuznetsov A E and Boldyrev A I 2004 Chem. Phys. Lett. 388 452
4. Selius J, Straka M and Sundholm D 2001 J. Phys. Chem. A105 9939
5. Kuznetsov A E, Birch K A, Boldyrev A I, Li X, Zhai H J and Wang L S 2003 Science 300 623
6. Mecero J M and Ugalde J M 2004 J. Am. Chem. Soc. 126 3380
7. Fowler P W, Havenith RWA and Steiner E 2001 Chem. Phys. Lett. 342 85
8. Fowler P W, Havenith RWA and Steiner E 2002 Chem. Phys. Lett. 359 530
9. Kuznetsov A E, Boldyrev A I, Li X and Wang L S 2001 J. Am. Chem. Soc. 123 8825
10. Kuznetsov A E and Boldyrev A I 2002 Inorg. Chem. 41532
11. Kunznetsov AE and Boldyrev AI 2002 Struct. Chem. 13 141
12. Zhai H, Wang L, Kunznetsov AE and Boldyrev A I 2002 J. Phys. Chem. A106 5600
13. Kunznetsov AE, Boldyrev AI, Zhai H, Li X and Wang L 2002 J. Am. Chem. Soc. 124 11791
14. Zhan C G, Zheng F and Dixon DA 2002 J. Am. Chem. Soc. 124 14795
15. Kuznetsov A E, Corbett J D, Wang L S and Boldyrev A I 2001 Angew. Chem. Int. Ed. 40 3369
16. Li X, Zhang H F, Wang L S, Kuznetsov A E, Cannon N A and Boldyrev A I 2001 Angew. Chem. Int. Ed. 40 1867
17. Chi X X, Li X H, Chen X J and Yuang Z S 2004 J. Mol. Struct. (Theochem.) 677 21
18. Li Q, Gong L and Gao Z M 2004 Chem. Phys. Lett. 394 220
19. Zhao C and Balasubramaniam K 2004 J. Chem. Phys. 120 10501
20. Jung Y, Henine T, Schleyer P V R and Head-Gordon M 2004 J. Am. Chem. Soc. 126 3132
21. Tuononen H M, Suontamo R, Valkonen J and Laitinen R S 2004 J. Phys. Chem. A108 5670
22. Tsipis C A, Karagiannis E E, Kladou P F and Tsipis A C 2004 J. Am. Chem. Soc. 126 12916
23. Kuznetsov A E, Zhai H J, Wang L S and Boldyrev A I 2002 Inorg. Chem. 41 6062
24. Alexandrova A N, Boldyrev A I, Zhai H J, Wang L S, Steiner E and Flower P W 2002 J. Phys. Chem. A107 1359
25. Hu X, Li H, Liang W and Han S 2004 Chem. Phys. Lett. 397 180
26. Jin Q, Jin B, Xu W G 2004 Chem. Phys. Lett. 396 398
27. Havenith R W A and Lenthe J H V 2004 Chem. Phys. Lett. 385 198.
28. Havenith R W A, Flower P W, Steiner E, Shetty S, Kanhere D G and Pal S 2004 Phys. Chem. Chem. Phys. 6 285
29. Boldyrev AI and Wang L S 2001 J. Phys. Chem. A105 10775
30. Alexandrova AN and Boldyrev AI 2003 J. Phys. Chem. A107 554
31. Kuznetsov A E and Boldyrev AI 2002 Inorg. Chem. 41 3596
32. Zhai H J, Wang L S, Kuznetsov A E and Boldyrev A I 2002 J. Phys. Chem. A106 5600
33. Matxain J M, Ugalde J M, Towler M D and Needs R J J. Phys. Chem. A107 10004
34. Nigam S, Majumder C and Kulshreshtha S K 2005 J. Mol. Struct. (Theochem.) 755 187
35. (a) Schleyer P V R, Maerker C, Dransfeld A, Jiao H, N J R and Hommes E. 1996 J. Am. Chem. Soc. 118 6317;
36. (b) Schleyer P V R, Jiao H, Hommes N V E, Malkina V G and Malkina O L 1997 J. Am. Chem. Soc. 119 12669
37. (a) Becke A D 1998 Phys. Rev. A38 3098;
38. (b) Lee C, Yang W and Parr R G 1988 Phys. Rev. B37 785
39. Schmidt W et al 1993 J. Comput. Chem. 14 1347
40. Frisch M J et al 1998 GAUSSIAN-98, Gaussian Inc, Pittsburgh, PA