MFiX

MFiX

National Energy Technology Laboratory
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+

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About

GROMACS is a free and open source suite for high-performance molecular dynamics and output analysis. It is a versatile package for simulating the Newtonian equations of motion for systems with hundreds to millions of particles, with a strong focus on materials modeling, biomolecular simulation, and particle-based systems. GROMACS is primarily designed for biochemical molecules such as proteins, lipids, and nucleic acids, which involve many complicated bonded interactions, but its speed in calculating nonbonded interactions also makes it useful for non-biological systems such as polymers and other materials. It can model ensembles of particles in liquid, solid, or gaseous states and supports a wide range of molecular dynamics workflows, from basic energy minimization and equilibration to production simulations and detailed trajectory analysis.

About

MFiX, or Multiphase Flow with Interphase eXchanges, is an open source multiphase flow solver and NETL’s flagship suite of computational fluid dynamics tool for modeling reacting multiphase flows. It has become a standard for comparing, implementing, and evaluating multiphase flow constitutive models, and has been applied to a diverse range of multiphase flow devices and industrial systems. MFiX provides multiple modeling approaches, including a Two-Fluid Model, Discrete Element Model, Coarse-Grained Particle DEM, Superquadric Particle DEM, Glued-Sphere Particle DEM, Particle-in-Cell model, hybrid methods, and a single-phase solver for pure granular flows. These models can be used to simulate gasifiers, circulating fluidized bed combustors, fluidized beds, fluid catalytic crackers, chemical looping combustion systems, and other particle-fluid systems involving hydrodynamics, heat transfer, species transport, and chemical reactions.

Platforms Supported

Windows
Mac
Linux
Cloud
On-Premises
iPhone
iPad
Android
Chromebook

Platforms Supported

Windows
Mac
Linux
Cloud
On-Premises
iPhone
iPad
Android
Chromebook

Audience

Computational chemists, biophysicists, materials scientists, and molecular simulation researchers who need a tool to model biomolecules and particle systems

Audience

Multiphase-flow researchers, engineers, and teams requiring to model gas-solids systems, particle-fluid interactions, and reacting multiphase flows

Support

Phone Support
24/7 Live Support
Online

Support

Phone Support
24/7 Live Support
Online

API

Offers API

API

Offers API

Screenshots and Videos

Screenshots and Videos

Pricing

Free
Free Version
Free Trial

Pricing

Free
Free Version
Free Trial

Reviews/Ratings

Overall 0.0 / 5
ease 0.0 / 5
features 0.0 / 5
design 0.0 / 5
support 0.0 / 5

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Reviews/Ratings

Overall 0.0 / 5
ease 0.0 / 5
features 0.0 / 5
design 0.0 / 5
support 0.0 / 5

This software hasn't been reviewed yet. Be the first to provide a review:

Review this Software

Training

Documentation
Webinars
Live Online
In Person

Training

Documentation
Webinars
Live Online
In Person

Company Information

GROMACS
United States
www.gromacs.org

Company Information

National Energy Technology Laboratory
United States
mfix.netl.doe.gov/products/mfix/

Alternatives

Alternatives

NAMD

NAMD

Theoretical and Computational Biophysics Group
Particleworks

Particleworks

Prometech Software
PFC (Particle Flow Code)

PFC (Particle Flow Code)

ITASCA Consulting
LIGGGHTS

LIGGGHTS

CFDEM

Categories

Categories

Integrations

Python

Integrations

Python
Claim GROMACS and update features and information
Claim GROMACS and update features and information
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Claim MFiX and update features and information