Matrix-isolation FT-IR study of (CsBr)n and (CsI)n (n = 1-3)

Vibrational Spectroscopy

Volumn 54, Issue 1, 2010, Pages 30-34

  Groen, Cornelis Petrus ^a   Kovács, Attila ^b,c  

^a URENCO UK Limited   (United Kingdom)

^b BUDAPEST UNIVERSITY OF TECHNOLOGY AND ECONOMICS   (Hungary)

^c JOINT RESEARCH CENTRE   (Italy)

Author keywords

Caesium halides; DFT computations; Dimer; FT IR spectroscopy; Matrix isolation; Trimer

Indexed keywords

CAESIUM HALIDES; DFT COMPUTATIONS; FTIR SPECTROSCOPY; MATRIX ISOLATION; TRIMER;

ALKALI HALIDES; ALKALINITY; CESIUM; ISOMERS; KRYPTON; MONOMERS; QUANTUM CHEMISTRY; XENON;

MATRIX ALGEBRA;

EID: 77955715994     PISSN: 09242031     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.vibspec.2010.06.001     Document Type: Article

References (37)

1. K. Hilpert, and U. Niemann Thermochim. Acta 299 1997 49 57
2. K. Minato J. Nucl. Mater. 185 1991 154 158
3. E.H.P. Cordfunke, and R.J.M. Konings J. Nucl. Mater. 201 1993 57 69
4. Z. Maruyama, H. Shibazaki, M. Igarashi, A. Maeda, Z. Harada, A. Hidaka, J. Sugimoto, K. Hashimoto, and N. Nakamura J. Nucl. Sci. Technol. 36 1999 433 442
5. A. Auvinen, K.E.J. Lehtinen, J. Enriquez, J.K. Jokiniemi, and R. Zilliacus J. Aerosol Sci. 31 2000 1029 1043
6. J.A. Garland, and R. Wakeford Atmos. Environ. 41 2007 3904 3920
7. A. Hidaka, Y. Maruyama, M. Igarashi, K. Hashimoto, and J. Sugimoto Nucl. Eng. Des. 200 2000 303 315
8. E. Walle, P. Perrot, J. Foct, and M. Parise J. Phys. Chem. Solids 66 2005 655 664
9. E.H.P. Cordfunke Thermochim. Acta 108 1986 45 55
10. K. Hilpert, M. Miller, and A. Feltrin F.W. Hilpert, L. Froben, Singheiser Proceedings of 10th International IUPAC Conference High Temperature Materials Chemistry, Schriften des Forschungszentrums Juelich, Reihe Energietechnik/Energy Technology 2000 Forschungszentrum Juelich GmbH 463 466
11. M.F. Butman, A.A. Smirnov, L.S. Kudin, and Z.A. Munir J. Mater. Synth. Process. 8 2000 93 100
12. R. Viswanathan, and K. Hilpert Ber. Bunsenges. Physik. Chem. 88 1984 125 131
13. K. Hilpert, and L. Bencivenni Surf. Sci. 156 1985 436 443
14. E.H.P. Cordfunke, and R.J.M. Konings Thermochemical Data for Reactor Materials and Fission Products 1990 North-Holland Amsterdam
15. V.P. Glushko, L.V. Gurvich, G.A. Bergman, I.V. Veyts, V.A. Medvedev, G.A. Khachkuruzov, and V.S. Yungman Termodinamicheskie Svojstva Individual'nykh Veshchestv 1982 Nauka Moscow
16. J. Rusk, and W. Gordy Phys. Rev. 127 1962 817
17. V. Braun, B. Guo, K.-Q. Zhang, M. Dulick, P.F. Bernath, and G.A. McRae Chem. Phys. Lett. 228 1994 633 640
18. J.G. Hartley, and M. Fink J. Chem. Phys. 87 1987 5477 5482
19. J.G. Hartley, and M. Fink J. Chem. Phys. 89 1988 6053 6057
20. Y. Kurosaki, L. Matsuoka, and K. Yokoyama J. Chem. Phys. 128 2008 024301
21. D.O. Welch, O.W. Lazareth, G.J. Dienes, and R.D. Hatcher J. Chem. Phys. 64 1976 835 839
22. F. Ramondo, L. Bencivenni, and V. Rossi J. Mol. Struct. 192 1989 73 82
23. T. Törring, S. Biermann, J. Hoeft, R. Mawhorter, R.J. Cave, and C. Szemenyei J. Chem. Phys. 104 1996 8032 8042
24. A. Streitwieser, J.C.-Y. Liang, E.G. Jayasree, and F. Hasanayn J. Chem. Theor. Comput. 3 2007 127 131
25. T.P. Martin, and H. Schaber J. Chem. Phys. 68 1978 4299 4303
26. R.J.M. Konings, A.S. Booij, and E.H.P. Cordfunke Vib. Spectrosc. 2 1991 251 255
27. R. Honerjäger, and R.R. Tischer Z. Naturforsch. 29a 1974 819 821
28. Z. Varga, C.P. Groen, M. Kolonits, M. Hargittai, Dalton Trans., in press, doi:10.1039/c001182g.
29. T. Klotzbücher, W. Pfleging, D.A. Wesner, M. Mergens, and E.W. Kreutz Diam. Rel. Mater. 5 1996 525 529
30. http://www.theochem.uni-stuttgart.de/pseudopotentials/.
31. A.D. Becke J. Chem. Phys. 1993 5648 5652
32. J.P. Perdew Phys. Rev. B 33 1986 8822 8824
33. I.S. Lim, P. Schwerdtfeger, B. Metz, and H. Stoll J. Chem. Phys. 122 2005 104103
34. K.A. Peterson, D. Figgen, E. Goll, H. Stoll, and M. Dolg J. Chem. Phys. 119 2003 11113
35. K.A. Peterson, B.C. Shepler, D. Figgen, and H. Stoll J. Phys. Chem. A 110 2006 13877
36. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, J.A. Montgomery Jr., T. Vreven, K.N. Kudin, J.C. Burant, J.M. Millam, S.S. Iyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G.A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J.E. Knox, H.P. Hratchian, J.B. Cross, V. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, P.Y. Ayala, K. Morokuma, G.A. Voth, P. Salvador, J.J. Dannenberg, V.G. Zakrzewski, S. Dapprich, A.D. Daniels, M.C. Strain, O. Farkas, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J.V. Ortiz, Q. Cui, A.G. Baboul, S. Clifford, J. Cioslowski, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, C. Gonzalez, and J.A. Pople Gaussian 03, Revision B.05 2004 Gaussian, Inc. Wallingford, CT
37. M. Hargittai Chem. Rev. 100 2000 2233 2301