Phase transitions and electrochemical properties of ionic liquids and ionic liquid—Solvent mixtures
Recent advances in studies of ionic liquids (IL) and ionic liquid–solvent mixtures are
reviewed. Selected experimental, simulation, and theoretical results for electrochemical …
reviewed. Selected experimental, simulation, and theoretical results for electrochemical …
Sorption in CSH at the molecular level: Disjoining pressures, effective interactions, hysteresis, and cavitation
Sorption processes are critical for drying and durability of cement-based materials. By
means of molecular simulations, we study the behavior of CSH upon sorption according to …
means of molecular simulations, we study the behavior of CSH upon sorption according to …
What is shape? Characterizing particle morphology with genetic algorithms and deep generative models
Engineered granular materials have gained considerable interest in recent years. For this
substance, the primary design variable is grain shape. Optimizing grain form to achieve a …
substance, the primary design variable is grain shape. Optimizing grain form to achieve a …
Replica exchange molecular dynamics simulation of organic matter evolution: From lignin to overmature type iii kerogen
Much more than any other form of carbon, kerogen undergoes considerable chemical and
structural evolution during natural maturation. Some properties, such as gas adsorption and …
structural evolution during natural maturation. Some properties, such as gas adsorption and …
Measuring Terzaghi's effective stress by decoding force transmission in fluid-saturated granular media
Force transmission between solid and fluid phases in fluid-saturated granular systems is yet
to be fully resolved. This is rooted in our inability to measure inter-particle forces in opaque …
to be fully resolved. This is rooted in our inability to measure inter-particle forces in opaque …
Active do** controls the mode of failure in dense colloidal gels
Mechanical properties of disordered materials are governed by their underlying free energy
landscape. In contrast to external fields, embedding a small fraction of active particles within …
landscape. In contrast to external fields, embedding a small fraction of active particles within …
A poroelasticity theory for soil incorporating adsorption and capillarity
Adsorption and capillarity, in the order of high free energy to low, are the two soil–water
interaction mechanisms controlling the hydro-mechanical behaviour of soils. Yet most of the …
interaction mechanisms controlling the hydro-mechanical behaviour of soils. Yet most of the …
Ultrananoporous supercapacitor with ionic liquid comprised of two-site cation: an Ising model study (II)
S Zhou, R Zhou - Journal of Physics D: Applied Physics, 2022 - iopscience.iop.org
A four-state one-dimension discrete spin model with the nearest neighbor and partial next
nearest neighbor lattice interactions is proposed for describing electrical double layer …
nearest neighbor lattice interactions is proposed for describing electrical double layer …
Influence of ion structure and solvent electric dipole on ultrananoporous supercapacitor: a lattice model study
S Zhou, R Zhou - Physica Scripta, 2022 - iopscience.iop.org
A five-state modified BEG model is proposed for describing electrolyte in polar solvent in
cylindrical electrode pore in which only one row of particles can be stationed. Two properties …
cylindrical electrode pore in which only one row of particles can be stationed. Two properties …
Image charge effects under metal and dielectric boundary conditions
The image charge (IC) effect is a fundamental problem in electrostatics. However, proper
treatment at the continuum level for many-ion systems, such as electrolyte solutions or ionic …
treatment at the continuum level for many-ion systems, such as electrolyte solutions or ionic …