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Using a dynamical density functional theory we analyze the density profile of a colloidal liquid near a wall under shear flow. Due to the symmetries of the system considered, the naive application of dynamical density functional theory does…

Soft Condensed Matter · Physics 2015-05-20 J. M. Brader , M. Krüger

We present dynamic density functional theory (DDFT) incorporating general inhomogeneous, incompressible, time dependent background flows and inertia, describing externally driven passive colloidal systems out of equilibrium. We start by…

Soft Condensed Matter · Physics 2024-09-11 Rory D. Mills-Williams , Benjamin D. Goddard , Andrew J. Archer

A recently proposed rational-function approximation [Phys. Rev. E \textbf{84}, 041201 (2011)] for the structural properties of nonadditive hard spheres is applied to evaluate analytically (in Laplace space) the local density profiles of…

Soft Condensed Matter · Physics 2013-04-08 Riccardo Fantoni , Andrés Santos

We develop a dynamical density functional theory based model for the drying of colloidal films on planar surfaces. We consider mixtures of two different sizes of hard-sphere colloids. Depending on the solvent evaporation rate and the…

Soft Condensed Matter · Physics 2021-01-28 Boshen He , Ignacio Martin-Fabiani , Roland Roth , Gyula I. Tóth , Andrew J. Archer

Subsystem Density-Functional Theory (DFT) is an emerging technique for calculating the electronic structure of complex molecular and condensed phase systems. In this topical review, we focus on some recent advances in this field related to…

Chemical Physics · Physics 2015-06-24 Alisa Krishtal , Debalina Sinha , Alessandro Genova , Michele Pavanello

We introduce a density functional formalism to study the ground-state properties of strongly-correlated dipolar and ionic ultracold bosonic and fermionic gases, based on the self-consistent combination of the weak and the strong coupling…

We present a new density functional, which is the result of a natural evolution and improvement of previous density functional theories for liquid helium. We focus on the key ingredients of the theory, showing how they determine important…

Condensed Matter · Physics 2007-05-23 Franco Dalfovo , Andrea Lastri , Sandro Stringari

We compare several definitions of the density of a self-bound system, such as a nucleus, in relation with its center-of-mass zero-point motion. A trivial deconvolution relates the internal density to the density defined in the laboratory…

Nuclear Theory · Physics 2007-07-27 B. G. Giraud

Due to the gas rich environments of early circumstellar disks, the gravitational collapse of cool, dense regions of the disk form fragments largely composed of gas. During formation, disk fragments may attain increased metallicities as they…

Earth and Planetary Astrophysics · Physics 2019-08-26 Hans Baehr , Hubert Klahr

In this paper we perform a Quantal Density Functional Theory (Q-DFT) study of the Hydrogen molecule in its ground state.

Materials Science · Physics 2009-11-10 Xiao-Yin Pan , Viraht Sahni

We reexamine results obtained with the recently proposed density functional theory framework based on forces (force-DFT) [Tschopp et al., Phys. Rev. E 106, 014115 (2022)]. We compare inhomogeneous density profiles for hard sphere fluids to…

Soft Condensed Matter · Physics 2024-02-28 Florian Sammüller , Sophie Hermann , Matthias Schmidt

We construct a density functional theory for two-dimension electron (hole) gases subjected to both strong magnetic fields and external potentials. In particular, we are focused on regimes near even-denominator filling factors, in which the…

Strongly Correlated Electrons · Physics 2019-03-11 Yinhan Zhang , Junren Shi

The success of density functional theory for the description of the adsorption of atoms on surfaces is well established, and based on recent calculations using gradient corrections, it has been shown that it also describes well the…

mtrl-th · Physics 2008-02-03 Catherine Stampfl

We prove a novel inversion theorem for functionals given as power series in infinite-dimensional spaces and apply it to the inversion of the density-activity relation for inhomogeneous systems. This provides a rigorous framework to prove…

Mathematical Physics · Physics 2019-09-11 Sabine Jansen , Tobias Kuna , Dimitrios Tsagkarogiannis

We describe an educational simulation of some effects within the gas of hard spheres. The focus of the presented simulation is on the comprehension of random character of the velocity of molecules in the gas and of the energy at fixed…

Physics Education · Physics 2008-11-06 Michal Meres , Boris Tomasik

Cool a piece of the Sun to 1000 K at one millibar pressure to yield a mineral assemblage consistent with those found in the most primitive meteorites. This is an equilibrium or fractional condensation experiment simulated by calculations…

Earth and Planetary Astrophysics · Physics 2023-06-28 Denton S. Ebel

The description of gravity in the form of an embedding theory is based on the hypothesis that our space-time is a four-dimensional surface in a flat ten-dimensional space. The choice of standard Einstein-Hilbert action leads in this case to…

General Relativity and Quantum Cosmology · Physics 2023-07-06 S. A. Paston , A. D. Kapustin

Thermal convection is observed in molecular dynamic simulation of a fluidized granular system of nearly elastic hard disks moving under gravity, inside a rectangular box. Boundaries introduce no shearing or time dependence, but the energy…

Statistical Mechanics · Physics 2009-10-31 Rosa Ramirez , Dino Risso , Patricio Cordero

Time-dependent density functional theory is extended to include dissipative systems evolving under a master equation, providing a Hamiltonian treatment for molecular electronics. For weak electric fields, the isothermal conductivity is…

Materials Science · Physics 2007-05-23 Kieron Burke , Roberto Car , Ralph Gebauer

This paper constructs a theoretical framework for calculating the distribution of masses for secondary bodies forming via gravitational instability in the outer regions of circumstellar disks. We show that several alternate ways to specify…

Earth and Planetary Astrophysics · Physics 2025-08-13 Fred C. Adams , Aster G. Taylor , Michael R. Meyer
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