Chemical bond elongation following core-excitation of ammonia : resonant Auger spectra calculation
Journal of Physics B: Atomic, Molecular and Optical Physics Volume 42 Issue 24
published_at 2009
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| File | |
| Title ( eng ) |
Chemical bond elongation following core-excitation of ammonia : resonant Auger spectra calculation
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| Creator |
Matsuyama Kodai
Tabayashi Kiyohiko
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| Source Title |
Journal of Physics B: Atomic, Molecular and Optical Physics
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| Volume | 42 |
| Issue | 24 |
| Abstract |
Theoretical resonant Auger decay spectra of ammonia with core-hole excited state dynamics simulation were investigated and some specific features of the experiment, except for a vibrational structure, were reproduced. A power spectral analysis with short-time maximum entropy method has been applied, and an obtained vibrational spacing assigned to the NH stretching mode was 340 meV, which was consistent with the experiment of 390 +/- 10 meV. Proton dynamics of ammonia on the first core-excited state was discussed.
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| NDC |
Physics [ 420 ]
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| Language |
eng
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| Resource Type | journal article |
| Publisher |
IOP Publishing Ltd
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| Date of Issued | 2009 |
| Rights |
Copyright (c) Institute of Physics and IOP Publishing Limited 2009.
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| Publish Type | Author’s Original |
| Access Rights | open access |
| Source Identifier |
[ISSN] 0953-4075
[DOI] 10.1088/0953-4075/42/24/245102
[NCID] AA10693237
[DOI] http://dx.doi.org/10.1088/0953-4075/42/24/245102
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