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Vibrational analysis of an ice Ih model from 0 to 4000 cm(-1) using the ab initio WHBB potential energy surface

Hanchao Liu1, Yimin Wang, Joel M Bowman

  • 1Cherry L. Emerson Center for Scientific Computation and Department of Chemistry, Emory University, Atlanta, Georgia 30322, USA.

The Journal of Physical Chemistry. B
|August 9, 2013
PubMed

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