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cdft_package

A python package for classical Density Functional Theory (cDFT). This package allows you to find the equilibrium density profile of an inhomogeneous one-component hard-sphere or truncated Lennard-Jones fluid in contact with a smooth planar surface, smooth solute or confined within a slit with smooth walls. These surfaces and solutes can be hard or

dbdb

Source code for "Pore-Size Distribution of Silica Colloidal Crystals from Nitrogen Adsorption Isotherms" article

dft

A classical Density Functional Theory code to calculate the properties of hard spheres or Lennard-Jones particles in planar geometry i.e. near an infinite hard or soft wall.

hello-world

Hello World repository. Please don't join.

machinelearning_lennardjones

raspa2

Classical molecular simulation code

the-solution-of-ill-posed-inverse-problems

Support material for book Leonov A.S. The solution of ill-posed inverse problems. Matlab implementation

tramonto

Primary source code repository for Tramonto - software that can be used to model nanostructured fluids using Density Functional Theories and Trilinos solvers

tramonto.github.io

Website for Tramonto: Software for Nanostructured Fluids based on Density Functional Theory methods using Trilinos solvers: