Go to content
UR Home

Thermodynamic properties of water from combined quantum and statistical mechanics in the temperature range from 273.16 to 423.15 K

Krienke, Hartmut ; Schmeer, Georg ; Strasser, Andrea



Abstract

A combined integral equation and quantum mechanical method, the so-called RISM–SCF method, is used to develop a self consistent effective potential model to describe pure liquid water in accordance with thermodynamic properties like chemical potential or entropy over a wide range of temperature and pressure. Since the thermodynamic excess properties calculated with the SSOZ equation are extremely ...

plus


Owner only: item control page
  1. Homepage UR

University Library

Publication Server

Contact:

Publishing: oa@ur.de

Dissertations: dissertationen@ur.de

Research data: daten@ur.de

Contact persons