FEASST
v0.25.3
Overview
Tutorials
Text Interface
Particle files and units
C++ Interface
Threads
Utilities
Math
Configuration
System
Monte Carlo
Models
Steppers
Flat histogram
Patch
Mayer
XTC
Chain
Shape
Confinement
Slab, cylindrical, spherical and mixed confinement
Grand Canonical Flat Histogram Simulation of Lennard-Jones in a simple WCA porous network
Grand Canonical Flat Histogram Simulation of TraPPE CO2 in ZIF8
FEASST plugin dependencies
API
HenryCoefficient
ModelTableCart1DHard
ModelSquareWellShape
ModelLJShape
ModelHardShape
confinement/include/trial_anywhere
Background
Charge
Optimized Lennard-Jones
Cluster
Expanded Grand Canonical Ensemble
Morph
Beta expanded
Prefetch
Aniso
Modify FEASST
Gibbs
Server
Model Expanded
FFTW
NetCDF
MPI
Modify FEASST
pyfeasst
Python Interface
Contact
Contributing
Acknowledgement
Citation
FEASST
National Institute of Standards and Technology
»
C++ Interface
»
Confinement
Confinement
This is a plugin for confinement.
Slab, cylindrical, spherical and mixed confinement
Grand Canonical Flat Histogram Simulation of Lennard-Jones in a simple WCA porous network
Grand Canonical Flat Histogram Simulation of TraPPE CO2 in ZIF8
FEASST plugin dependencies
monte_carlo
shape
API
HenryCoefficient
ModelTableCart1DHard
ModelSquareWellShape
ModelLJShape
ModelHardShape
confinement/include/trial_anywhere
Background