Determination of phase diagrams via computer simulation: methodology and applications to water, electrolytes and proteins

C Vega, E Sanz, JLF Abascal… - Journal of Physics …, 2008 - iopscience.iop.org
In this review we focus on the determination of phase diagrams by computer simulation, with
particular attention to the fluid–solid and solid–solid equilibria. The methodology to compute …

Review on the structure of random packed‐beds

J von Seckendorff, O Hinrichsen - The Canadian Journal of …, 2021 - Wiley Online Library
Independent from their intended purpose, the understanding of structural characteristics of
random packings of particles having defined shapes is important to understand and optimize …

[图书][B] Colloids and the depletion interaction

HNW Lekkerkerker, R Tuinier, M Vis - 2024 - library.oapen.org
This open access book provides a detailed exploration of the phase behaviour of, and
interfacial properties in, complex colloidal mixtures (eg, clay, milk, blood). Insights into …

Tracing the phase boundaries of hard spherocylinders

P Bolhuis, D Frenkel - The Journal of chemical physics, 1997 - pubs.aip.org
We have mapped out the complete phase diagram of hard spherocylinders as a function of
the shape anisotropy L/D. Special computational techniques were required to locate phase …

CdSe and CdSe/CdS nanorod solids

DV Talapin, EV Shevchenko, CB Murray… - Journal of the …, 2004 - ACS Publications
We demonstate the self-organization of CdSe nanorods into nematic, smectic, and
crystalline solids. Layered colloidal crystals of CdSe nanorods grow by slow destabilization …

Multiscale polar theory of microtubule and motor-protein assemblies

T Gao, R Blackwell, MA Glaser, MD Betterton… - Physical review …, 2015 - APS
Microtubules and motor proteins are building blocks of self-organized subcellular biological
structures such as the mitotic spindle and the centrosomal microtubule array. These same …

Computer simulation of liquid crystals

CM Care, DJ Cleaver - Reports on progress in physics, 2005 - iopscience.iop.org
A review is presented of molecular and mesoscopic computer simulations of liquid
crystalline systems. Molecular simulation approaches applied to such systems are …

Liquid crystal phase transitions in suspensions of mineral colloids: new life from old roots

HNW Lekkerkerker, GJ Vroege - … Transactions of the …, 2013 - royalsocietypublishing.org
A review is given of the field of mineral colloidal liquid crystals: liquid crystal phases formed
by individual mineral particles within colloidal suspensions. Starting from their discovery in …

The effect of dipolar forces on the structure and thermodynamics of classical fluids

PIC Teixeira, JM Tavares… - Journal of Physics …, 2000 - iopscience.iop.org
The present understanding of how dipolar forces affect the structure and phase behaviour of
classical fluids is reviewed. We focus mainly on the apparent absence of a liquid-vapour …

Numerical study of the phase behavior of rodlike colloids with attractive interactions

PG Bolhuis, A Stroobants, D Frenkel… - The Journal of …, 1997 - pubs.aip.org
We examine the influence of attractive interactions on the phase behavior of rodlike colloids.
We model the rodlike particles by spherocylinders, for which the phase diagram, in the …