We use a version of the density functional theory to study the solvation force between two plates modified with a tethered layer of chains. The chains are built of tangentially jointed charged spherical segments. The plates are immersed in an electrolyte solution that involves cations, anions and solvent molecules. The latter molecules are modelled as hard spheres. We study the dependence of the solvation force and the structure of chains and of solute molecules on the grafting density, length of chains, architecture of the chains and on concentration of the solute
We combine the statistical\u2013mechanical 1D/3D-RISM-KH molecular theory of solvation with DFT elec...
The influence of intrinsic chain stiffness on surface forces in solutions containing semiflexible po...
We have simulated interactions between charged surfaces in the presence of oppositely charged polyel...
In this letter we discusses the first application of 3-dimensional nonlocal density functional calcu...
We report a nonlocal density functional theory (NLDFT) for polyelectrolyte solutions within the prim...
In this letter we discusses the application of a 3-dimensional imple-mentation of a geometry-based n...
Conformations of weakly charged quenched polyelectrolyte chains tethered to a similarly charged plan...
The forces between two charged thick plates immersed in a model fluid are investigated using the den...
© 2017 American Chemical Society. We illustrate the effects of chain connectivity on the solvation e...
A mean field continuum model has been used to predict the free energy of interaction between the lay...
Recent years have witnessed a renewed interest in statistical mechanics of solvation directed toward...
We illustrate the effects of chain connectivity on the solvation energy of ions immersed in polymer ...
This thesis presents a new framework for studying colloidal forces. This framework combines accurate...
We use a version of the density functional theory to study the changes in the height of the tethered...
We use a numerical implementation of polymer classical density functional theory with an incompressi...
We combine the statistical\u2013mechanical 1D/3D-RISM-KH molecular theory of solvation with DFT elec...
The influence of intrinsic chain stiffness on surface forces in solutions containing semiflexible po...
We have simulated interactions between charged surfaces in the presence of oppositely charged polyel...
In this letter we discusses the first application of 3-dimensional nonlocal density functional calcu...
We report a nonlocal density functional theory (NLDFT) for polyelectrolyte solutions within the prim...
In this letter we discusses the application of a 3-dimensional imple-mentation of a geometry-based n...
Conformations of weakly charged quenched polyelectrolyte chains tethered to a similarly charged plan...
The forces between two charged thick plates immersed in a model fluid are investigated using the den...
© 2017 American Chemical Society. We illustrate the effects of chain connectivity on the solvation e...
A mean field continuum model has been used to predict the free energy of interaction between the lay...
Recent years have witnessed a renewed interest in statistical mechanics of solvation directed toward...
We illustrate the effects of chain connectivity on the solvation energy of ions immersed in polymer ...
This thesis presents a new framework for studying colloidal forces. This framework combines accurate...
We use a version of the density functional theory to study the changes in the height of the tethered...
We use a numerical implementation of polymer classical density functional theory with an incompressi...
We combine the statistical\u2013mechanical 1D/3D-RISM-KH molecular theory of solvation with DFT elec...
The influence of intrinsic chain stiffness on surface forces in solutions containing semiflexible po...
We have simulated interactions between charged surfaces in the presence of oppositely charged polyel...