Structure, dynamics and vibrational spectrum of supercritical CO2/H2O mixtures from ab initio molecular dynamics as a function of water cluster formation

Journal Article
Physical Chemistry Chemical Physics, vol. 12, iss. 31, pp. 8759, 2010
Authors
Vassiliki-Alexandra Glezakou, Roger Rousseau, Liem X. Dang, B. Peter McGrail
English