The dependence on structure of the projected vibrational density of states of various phases of ice as calculated by ab initio methods
(2001)
Journal Article
Jenkins, S., & Morrison, I. (2001). The dependence on structure of the projected vibrational density of states of various phases of ice as calculated by ab initio methods. Journal of Physics: Condensed Matter, 13(41), 9207-9229. https://doi.org/10.1088/0953-8984/13/41/312
We determine the structural data of seven of the polymorphs of ice (ice Ih, ice Ic, ice IX, ice II, ice VI, ice VII and ice VIII) from ab initio calculations. The dynamical properties have been analysed within the harmonic approximation via a finite-... Read More about The dependence on structure of the projected vibrational density of states of various phases of ice as calculated by ab initio methods.