화학공학소재연구정보센터
Chemical Physics Letters, Vol.439, No.1-3, 55-59, 2007
Electron momentum spectroscopy of the valence orbitals of the water molecule in gas and liquid phase: A comparative study
We present a comparative study of the electron momentum spectroscopy (EMS) of the valence orbitals of the water molecule in gas and liquid phases. The molecular properties of the water molecule in liquid water have been computed within the framework of the polarizable continuum model. Surprisingly, we find that, although most of the molecular properties of the water molecule do show significant differences between gas and liquid phases, the shape of the EMS profiles are almost insensitive. (c) 2007 Elsevier B.V. All rights reserved.