Collect. Czech. Chem. Commun. 1998, 63, 1177-1186

Ab initio Calculation of Transport Properties of Supercritical Carbon Dioxide

Gerold Steinebrunner, Anthony J. Dyson, Barbara Kirchner and Hanspeter Huber

Institut für Physikalische Chemie, Universität Basel, Klingelbergstrasse 80, CH-4056 Basel, Switzerland

Individual author index pages

Other CCCC articles of these authors

  • Markus G. Müller and Hanspeter Huber*
    Linear Scaling with Cluster Size for Calculations of NMR Properties in Liquids
    2003, Vol. 68, Issue 12, pp. 2292–2296 [Abstract]
  • Muthusamy Venkatraj, Markus G. Müller, Hanspeter Huber* and Robert J. Gdanitz
    Calculation of Thermodynamical, Transport and Structural Properties of Neon in Liquid and Supercritical Phases by Molecular Dynamics Simulations Using an Accurate ab initio Pair Potential
    2003, Vol. 68, Issue 3, pp. 627–643 [Abstract]
  • Stefan Gerber and Hanspeter Huber
    The sulfur dioxide-hydrogen fluoride complex. Additional information to the experiment from ab initiocalculations
    1988, Vol. 53, Issue 9, pp. 1989–1994 [Abstract]
  • Hanspeter Huber, J. Pancíř and P. Čársky
    Effective search for minima on the ab initio SCF energy hypersurfaces
    1977, Vol. 42, Issue 9, pp. 2767–2771 [Abstract]