J4 ›› 2013, Vol. 30 ›› Issue (3): 280-283.

• Spectrascopy • Previous Articles     Next Articles

Multiphoton ionization mass spectrum of alcohol -water complex cluster and ab initio calculation

XU Ming- kun, WANG Xiang-xian, YU Jian-li, Ye Song   

  1. Department of Physics And Electronics,Chaohu University, Chaohu 238000,China
  • Received:2012-05-24 Revised:2012-07-31 Published:2013-05-28 Online:2013-05-06

Abstract: Alcohol-water complex clusters were studied by using multiphoton ionization technique and time-of-flight mass spectrometer. Laser with 355nm wavelengths were used as ionized source, protonated cluster ions (ROH)n(H2O)H+ and (ROH)nH+ were observed where the R=CH3 or C2H5. The formation of (ROH)n(H2O)H+ is mainly through proton transfer reaction intra alcohol-water clusters ions after laser multiphoton ionization. Some possible geometric structures of (CH3OH)n(H2O)H+ with relatively small sizes were guessed using ab initio calculation method. The structures show that the (CH3OH)H+ trends as the ion’s center, and then it combines with other methanol or ethanol molecule to form the final stable complex cluster ions.

Key words: spectroscopy, protonated clusters, multiphoton ionization, time-of-flight mass spectrum

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