Corrigendum to: Jahn-Teller Effects in Molecular Cations Studied by Photoelectron Spectroscopy and Group Theory (Angewandte Chemie International Edition, (2009), 48, 35, (6404-6424), 10.1002/anie.200900526);Jahn-Teller effects in molecular cations studied by photoelectron spectroscopy and group theory

Angewandte Chemie - International Edition

Volumn 48, Issue 35, 2009, Pages 6404-6424

  Wòrner, Hans Jakob ^a   Frédéric, Merkt ^a  

^a ETH ZURICH   (Switzerland)

Author keywords

Ab initio calculations; Fluxionality; Isomerization; Jahn Teller Effect; Photoelectron spectroscopy; isomerization; fluxionality; Jahn Teller effect; ab initio calculations; photoelectron spectroscopy

Indexed keywords

CALCULATIONS; ISOMERIZATION; ISOMERS; JAHN-TELLER EFFECT; PHOTOELECTRON SPECTROSCOPY; PHOTOELECTRONS; PHOTONS; POSITIVE IONS; POTENTIAL ENERGY; QUANTUM CHEMISTRY; STEREOCHEMISTRY;

AB INITIO CALCULATIONS; CYCLOPENTADIENYLS; DEGENERATE ELECTRONIC STATE; ELECTRONIC LOCALIZATION; EXPERIMENTAL CHARACTERIZATION; FLUXIONALITY; PERMUTATIONAL SYMMETRY; PHYSICAL MECHANISM;

GROUP THEORY;

EID: 70349909330     PISSN: 14337851     EISSN: 15213773     Source Type: Journal    
DOI: 10.1002/anie.202016700     Document Type: Erratum

References (100)

1. I. B. Bersuker, The Jahn-Teller Effect, Cambridge University Press, Cambridge, 2006.
2. Conical Intersections: Electronic Structure, Dynamics and Spectroscopy (Eds.: W. Domcke, D. R. Yarkony, H. Koppel), World Scientific, Singapore, 2004 (Adv. Ser. Phys. Chem., Vol. 15).
3. H. A. Jahn, E. Teller, Proc. R. Soc. London Ser. A 1937, 161, 220.
4. H. A. Jahn, Proc. R. Soc. London Ser. A 1938, 164, 117.
5. H. C. Longuet-Higgins, U. Opik, M. H. L. Pryce, R. A. Sack, Proc. R. Soc. London Ser. A 1958, 244, 1.
6. H. C. Longuet-Higgins, Advances in Spectroscopy, Vol.2, Interscience, New York, 1961.
7. I. B. Bersuker, Sov. Phys. JETP 1963, 16, 933.
8. U. Öpik, M. H. L. Pryce, Proc. R. Soc. London Ser. A 1957, 238, 425.
9. H. von Busch, V. Dev, H.-A. Eckel, S. Kasahara, J. Wang, W. Demtröder, P. Sebald, W. Meyer, Phys. Rev. Lett. 1998, 81, 4584;
10. Erratum: H. von Busch, V. Dev, H.-A. Eckel, S. Kasahara, J. Wang, W. Demtröder, P. Sebald, W. Meyer, Phys. Rev. Lett. 1999, 82, 3560.
11. R. Meiswinkel, H. Koppel, Chem. Phys. 1990, 144, 117.
12. W. E. Ernst, S. Rakowsky, Phys. Rev. Lett. 1995, 74, 58.
13. R. Lindner, K. Müller-Dethlefs, E. Wedum, K. Haber, E. R. Grant, Science 1996, 271, 1698.
14. M. Ford, R. Lindner, K. Müller-Dethlefs, Mol. Phys. 2003, 101, 705.
15. H. Koppel, L. S. Cederbaum, W. Domcke, S. S. Shaik, Angew. Chem. 1983, 95, 221;
16. Angew. Chem. Int. Ed. Engl. 1983, 22, 210.
17. H. Koppel, W. Domcke, L. S. Cederbaum, Adv. Chem. Phys. 1984, 57, 59.
18. J. W. Zwanziger, E. R. Grant, J. Chem. Phys. 1987, 87, 2954.
19. T. A. Barckholtz, T. A. Miller, Int. Rev. Phys. Chem. 1998, 17, 435.
20. B. E. Applegate, T. A. Barckholtz, T. A. Miller, Chem. Soc. Rev. 2003, 32, 38.
21. 60 and Other Icosahedral Complexes, Princeton University Press, Princeton, 1997.
22. K. Müller-Dethlefs, E. W. Schlag, Annu. Rev. Phys. Chem. 1991, 42, 109.
23. K. Müller-Dethlefs, E. W. Schlag, Angew. Chem. 1998, 110, 1414;
24. Angew. Chem. Int. Ed. 1998, 37, 1346.
25. P. R. Bunker, P. lensen, Molecular Symmetry and Spectroscopy, 2nd ed., NRC Research Press, Ottawa, 1998.
26. H. Koppel, L. S. Cederbaum, W. Domcke, Chem. Phys. Lett. 1984, 110, 469.
27. I. B. Bersuker, V. Z. Polinger, Sov. Phys. JETP 1974, 39, 1023.
28. A. Bohm, A. Mostafazadeh, H. Koizumi, Q. Niu, J. Zwanziger, The Geometric Phase in Quantum Systems: Foundations, Mathematical Concepts and Applications in Molecular and Condensed Matter Physic, Springer, Heidelberg, 2003.
29. J. K. Cullum, R. A. Willoughby, Lanczos Algorithms for Large Symmetric Eigenvalue Computations, Birkhauser, Boston, 1985.
30. M. J. Paterson, M. J. Bearpark, M. A. Robb, L. Biancafort, G. A. Worth, Phys. Chem. Chem. Phys. 2005, 7, 2100.
31. G. Herzberg, H. C. Longuet-Higgins, Discuss. Faraday Soc. 1963, 35, 77.
32. H. J. Wörner, R. van der Veen, F. Merkt, Phys. Rev. Lett. 2006, 97, 173003.
33. W. T. Borden, Diradicals, Wiley, New York, 1982.
34. H. Koppel, L. S. Cederbaum, W. Domcke, J. Chem. Phys. 1988, 89, 2023.
35. J. K. G. Watson, MoI. Phys. 1999, 96, 1721.
36. W. T. Borden, E. R. Davidson, J. Am. Chem. Soc. 1979, 101, 3771.
37. H. J. Wörner, F. Merkt, J. Chem. Phys. 2007, 127, 034303.
38. M. N Paddon-Row, D. J. Fox, J. A. Pople, K. N Houk, D. W. Pratt, J. Am. Chem. Soc. 1985, 107, 7696.
39. R. F. Frey, E. R. Davidson, J. Chem. Phys. 1988, 88, 1775.
40. R. Signorell, F. Merkt, Faraday Discuss. 2000, 115, 205.
41. M. Quack, Angew. Chem. 1989, 101, 588;
42. Angew. Chem. Int. Ed. Engl. 1989, 28, 571.
43. M. Quack, J. Stohner, M. Willeke, Annu. Rev. Phys. Chem. 2008, 59, 741.
44. M. S. Reeves, E. R. Davidson, J. Chem. Phys. 1991, 95, 6551.
45. H. J. Wörner, X. Qian, F. Merkt, J. Chem. Phys. 2007, 126, 144305.
46. G. Herzberg, Molecular Spectra and Molecular Structure, Vol.II, Infrared and Raman Spectra of Polyatomic Molecules, Krieger, Malabar, 1991.
47. F. Merkt, Annu. Rev. Phys. Chem. 1997, 48, 675.
48. E. W. Schlag, ZEKE Spectroscopy, Cambridge University Press, Cambridge, 1998.
49. U Hollenstein, R. Seiler, H. Schmutz, M. Andrist, F. Merkt, J. Chem. Phys. 2001, 115, 5461.
50. D. E. Cooper, C. M. Klimack, J. E. Wessels, Phys. Rev. Lett. 1981, 46, 324.
51. B. Bobin, J. Phys. 1972, 33, 345.
52. S. Willitsch, J. M. Dyke, F. Merkt, Helv. Chim. Acta 2003, 86, 1152.
53. H. J. Wörner, F. Merkt, Angew. Chem. 2006, 118, 299;
54. Angew. Chem. Int. Ed. 2006, 45, 293.
55. M. Saunders, R. Berger, A. Jaffe, J. M. McBride, J. O'Neill, R. Breslow, J. M. Hoffmann, C. Perchonock, E. Wassermann, R. S. Hutton, V. J. Kuck, J. Am. Chem. Soc. 1973, 95, 3017.
56. T. Bally, S. Masamune, Tetrahedron 1980, 36, 343.
57. G. Maier, Angew. Chem. 1988, 100, 317;
58. Angew. Chem. Int. Ed. Engl. 1988, 27, 309.
59. R. Signorell, F. Merkt, J. Chem. Phys. 1999, 110, 2309.
60. M. Quack, Mol. Phys. 1977, 34, 477.
61. M. Hippler, M. Quack, Chem. Phys. Lett. 1999, 314, 273.
62. S. Willitsch, L. L. Imbach, F. Merkt, J. Chem. Phys. 2002, 117, 1939.
63. A. Carrington, H. Longuet-Higgins, R. Moss, P. Todd, Mol. Phys. 1965, 9, 187.
64. R. G. Lawler, J. R. Bolton, G. K. Fraenkel, T. H. Brown, J. Am. Chem. Soc. 1964, 86, 520.
65. B. Scharf, R. Vitenberg, B. Katz, Y. B. Band, J. Chem. Phys. 1982, 77, 2226.
66. L. Yu, D. W. Cullin, J. M. Williamson, T. A. Miller, J. Chem. Phys. 1993, 98, 2682.
67. H. J. Wörner, F. Merkt, J. Chem. Phys. 2007, 126, 154304.
68. R. Signorell, M. Sommavilla, F. Merkt, Chem. Phys. Lett. 1999, 312, 139.
69. M. Quack, Nova Acta Leopold. 1999, 81, 1.
70. R. Berger, G. Laubender, M. Quack, A. Sieben, J. Stohner, M. Willeke, Angew. Chem. 2005, 117, 3689;
71. Angew. Chem. Int. Ed. 2005, 44, 3623.
72. L. Wang, J. E. Pollard, Y. T. Lee, D. A. Shirley, J. Chem. Phys. 1987, 86, 3216.
73. S. Willitsch, U Hollenstein, F. Merkt, J. Chem. Phys. 2004, 120, 1761.
74. A. M. Schulenburg, Diss. ETH Nr. 18024, Dissertation, Eidgenössische Technische Hochschule ETH Zürich, 2008.
75. B. Fehrensen, D. Luckhaus, M. Quack, Chem. Phys. Lett. 1999, 300, 312.
76. M. Gottselig, D. Luckhaus, M. Quack, J. Stohner, M. Willeke, Helv. Chim. Acta 2001, 84, 1846.
77. R. Berger, M. Gottselig, M. Quack, M. Willeke, Angew. Chem. 2001, 113, 4342;
78. Angew. Chem. Int. Ed. 2001, 40, 4195.
79. M. Gottselig, M. Quack, J. Chem. Phys. 2005, 123, 084305.
80. M. J. M. Pepper, I. Shavitt, P. v. R. Schleyer, M. N Glukhovtsev, R. Janoschek, M. Quack, J. Comput. Chem. 1995, 16, 207.
81. 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. Kiene, 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, J. A. Pople. Gaussian 03, Revision C.02. Gaussian, Inc., Wallingford, CT, 2004.
82. A. Garg, Am. J. Phys. 2000, 68, 430.
83. J. T. Hougen in Methane Symmetry Operation, MTP International Reviews of Science, Physical Chemistry, Vol.3 (Eds.: D. A. Ramsay), Butterworth, London, 1976.
84. A. Olah, G. Rasul, Ace. Chem. Res. 1997, 30, 245.
85. E. Herbst, J. Phys. Chem. A 2005, 109, 4017.
86. E. T. White, J. Tang, T. Oka, Science 1999, 284, 135.
87. O. Asvany, P. Kumar, B. Redlich, I. Hegemann, S. Schlemmer, D. Marx, Science 2005, 309, 1219.
88. X. Huang, A. B. McCoy, J. M. Bowman, L. M. Johnson, C. Savage, F. Dong, D. J. Nesbitt, Science 2006, 311, 60.
89. X.-G. Wang, T. Carrington, Jr., J. Chem. Phys. 2008, 129, 234102.
90. A. Komornicki, D. A. Dixon, J. Chem. Phys. 1987, 86, 5625.
91. W. Klopper, W. Kutzelnigg, J. Phys. Chem. 1990, 94, 5625.
92. P. R. Schreiner, S.-J. Kim, H. F. Schäfer III, P. v. R. Schleyer, J. Chem. Phys. 1993, 99, 3716.
93. P. R. Schreiner, Angew. Chem. 2000, 112, 3375;
94. Angew. Chem. Int. Ed. 2000, 39, 3239.
95. A. Brown, A. B. McCoy, B. J. Braams, Z. Jin, J. M. Bowman, J. Chem. Phys. 2004, 121, 4105.
96. Z. Iin, B. J. Braams, J. M. Bowman, J. Phys. Chem. A 2006, 110, 1569.
97. P. R. Bunker, B. Ostojič, S. Yurchenko, J. Mol. Struct. 2004, 695-696, 253.
98. A. B. McCoy, B. J. Braams, A. Brown, X. Huang, Z. Jin, J. M. Bowman, J. Phys. Chem. A 2004, 108, 4991.
99. L. M. Johnson, A. B. McCoy, J. Phys. Chem. A 2006, 110, 8213.
100. X. Huang, L. M. Johnson, J. M. Bowman, A. B. McCoy, J. Am. Chem. Soc. 2006, 128, 3478.