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Stretching Vibrations of the Hydrogen Bond in HOHOH^- Hagedorn, George
Description
Low order Born-Oppenheimer approximations describe most molecular systems very well, but they fail for some molecules or ions, including many with Hydrogen bonds. Alternative approximations for Hydrogen bonded molecules were developed together with Alain Joye several years ago. With an emphasis on simplicity, we have recently attempted to apply the appropriate alternative approximation to HOHOH^-, in which the central Hydrogen nucleus feels a double well effective potential. We describe some preliminary results about the symmetric and asymmetric stretching vibrations of the Hydrogen bond in this ion.
Item Metadata
Title |
Stretching Vibrations of the Hydrogen Bond in HOHOH^-
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Creator | |
Publisher |
Banff International Research Station for Mathematical Innovation and Discovery
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Date Issued |
2016-01-26T13:30
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Description |
Low order Born-Oppenheimer approximations describe most molecular systems very well, but they fail for some molecules or ions, including many with Hydrogen bonds. Alternative approximations for Hydrogen bonded molecules were developed together with Alain Joye several years ago.
With an emphasis on simplicity, we have recently attempted to apply the appropriate alternative approximation to HOHOH^-, in which the central Hydrogen nucleus feels a double well effective potential. We describe some preliminary results about the symmetric and asymmetric
stretching vibrations of the Hydrogen bond in this ion.
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Extent |
19 minutes
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Subject | |
Type | |
File Format |
video/mp4
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Language |
eng
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Notes |
Author affiliation: Virginia Tech
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Series | |
Date Available |
2016-07-27
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Provider |
Vancouver : University of British Columbia Library
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Rights |
Attribution-NonCommercial-NoDerivatives 4.0 International
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DOI |
10.14288/1.0307152
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URI | |
Affiliation | |
Peer Review Status |
Unreviewed
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Scholarly Level |
Other
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Rights URI | |
Aggregated Source Repository |
DSpace
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Rights
Attribution-NonCommercial-NoDerivatives 4.0 International