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Excited electronic states of a hydrogen bond: Bifluoride ion

✍ Scribed by Richard Lozes; John R. Sabin

Publisher
John Wiley and Sons
Year
1979
Tongue
English
Weight
166 KB
Volume
16
Category
Article
ISSN
0020-7608

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✦ Synopsis

Abstract

We report here a summary of a limited CI calculation carried out on the C~∞v~ and D~∞h~ electronically excited states of bifluoride ion. This species is interesting as the prototype of a hydrogen‐bonded system. It is determined that the lowest‐lying excited states of the system are dissociative and/or autoionizing.

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The vibrational energy relaxation (VER) of polyatomic molecules has been the central issue in many of the chemical reactions in condensed phase [1][2][3][4][5][6][7][8][9][10][11][12][13][14][15][16][17] as well as in gas phase . The vibrational energy introduced to the molecule is immediately redis