Publication Date:
1985
abstract:
The origin of absolute and differential phase transition shifts of ionization energies of water is investigated by means of perturbation theory, supermolecular models and perturbational model calculations including results from molecular dynamics simulations. Applications are presented for ionization energy shifts following the phase transitions: water vapour-cubic iceliquid water.
Iris type:
01.01 Articolo in rivista
Keywords:
theory; ionization energy; phase shift; water
List of contributors:
Carravetta, Vincenzo
Published in: