The Way of Obtain C4H6O+ Macro Ion by C7H12O+ Excited State

Hong Bin Chen; Ying Zhu; Jie Wu

doi:10.4028/www.scientific.net/AMM.540.56

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The Way of Obtain C₄H₆O⁺ Macro Ion by C₇H₁₂O⁺ Excited State
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HomeApplied Mechanics and MaterialsApplied Mechanics and Materials Vol. 540The Way of Obtain C4H6O+ Macro Ion by C7H12O+...

The Way of Obtain C₄H₆O⁺ Macro Ion by C₇H₁₂O⁺ Excited State

Abstract:

Our theoretical study aims to analyze the Way of Obtain C₄H₆O⁺ macro ion by C₇H₁₂O⁺ Excited State and gives out a result with proved and directed significance for the corresponding experiments. Using the CIS(Configuration Interaction with Single Substitute) method, we calculated the frequency of cycloheptanone ion excited state. It is the parent ion 1C-7C, 4C-5C fracture, generates C₄H₆O⁺ pieces. It mainly through the fifth excited state occur the dissociation process.

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Periodical:

Applied Mechanics and Materials (Volume 540)

Pages:

56-59

DOI:

https://doi.org/10.4028/www.scientific.net/AMM.540.56

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Online since:

April 2014

Authors:

Hong Bin Chen, Ying Zhu*, Jie Wu

Keywords:

Cycloheptanone Ion, Dissociation, Excited State

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