NDLI: Vacuum ultraviolet mass-analyzed threshold ionization spectroscopy of methylcyclohexane in the supersonic jet

Content Provider	Semantic Scholar
Author	Han, Songhee Yoo, Hyun Sik Ahn, Doo-Sik Choi, Young Shin Kim, Sang Kyu
Copyright Year	2011
Abstract	Vacuum ultraviolet (VUV) mass-analyzed threshold ionization (MATI) spectrum of supersonically cooled methylcyclohexane has been obtained to give the precise adiabatic ionization energy of 9.6958 ± 0.0025 eV for the chair equatorial conformer. Vibrationally resolved MATI spectrum has been analyzed with the aid of density functional theory and Franck–Condon calculations. The MATI spectrum reflects the structural change upon ionization and its origin is discussed by inspecting the shapes of the valence orbitals involved in the ionization process. The spectroscopic implication of the structural interconversion above the certain energy level is discussed with theoretical calculations of molecular structures and energetics.
Starting Page	38
Ending Page	43
Page Count	6
File Format	PDF HTM / HTML
DOI	10.1016/j.cplett.2011.11.005
Alternate Webpage(s)	http://cdnl.kaist.ac.kr/LABjournal/83.pdf
Alternate Webpage(s)	https://doi.org/10.1016/j.cplett.2011.11.005
Volume Number	518
Language	English
Access Restriction	Open
Content Type	Text
Resource Type	Article

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