21 citations · 39 across the 4 of their papers we have counts for
4 papers
The role of attractive interactions in the dynamics of molecules in liquids
X. You, L. R. Pratt, S. W. Rick
The friction kernel (or memory function) characterizing single-molecule dynamics in strongly bound liquids exhibits two distinct relaxations with the longer time-scale relax…
Multi-scale theory in the molecular simulation of electrolyte solutions
W. Zhang, X. You, L. R. Pratt
This paper organizes McMillan-Mayer theory, the potential distribution approach, and quasi-chemical theory to provide theory for the thermodynamic effects associated with longer sp…
Interfaces of Propylene Carbonate
Xinli You, Mangesh I. Chaudhari, Lawrence R. Pratt +3
Propylene carbonate (PC) wets graphite with a contact angle of 31 deg at ambient conditions. Molecular dynamics simulations agree with this contact angle after 40% reduction of the…
Generalizations of the Fuoss Approximation for Ion Pairing
P. Zhu, X. You, L. R. Pratt +1
An elementary statistical observation identifies generalizations of the Fuoss approximation for the probability distribution function that describes ion clustering in electrolyte s…