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What is MFiX?

MFiX, an acronym for Multiphase Flow with Interphase eXchanges, is an open-source solver created for multiphase flow and is recognized as NETL's primary computational fluid dynamics tool suite for simulating reacting multiphase flows. This software has become a standard for evaluating, implementing, and analyzing constitutive models in multiphase flow environments and has been applied in a wide range of multiphase flow devices and industrial contexts. MFiX provides a diverse array of modeling techniques, such as the Two-Fluid Model, Discrete Element Model, Coarse-Grained Particle DEM, Superquadric Particle DEM, Glued-Sphere Particle DEM, as well as the Particle-in-Cell model and hybrid approaches, along with a specialized single-phase solver for granular flows. These sophisticated models facilitate the simulation of various systems including gasifiers, circulating fluidized bed combustors, fluidized beds, fluid catalytic crackers, and chemical looping combustion systems, tackling the intricate interactions of hydrodynamics, heat transfer, species transport, and numerous chemical reactions. Consequently, MFiX plays a vital role in enhancing the understanding and optimization of these complex processes, benefiting both academic research and industrial applications alike. Its ongoing development and community support further ensure that MFiX remains at the forefront of multiphase flow simulation technology.

What is GROMACS?

GROMACS is a powerful open-source software suite designed for high-performance molecular dynamics and output analysis. This versatile tool can simulate the Newtonian equations of motion for systems comprising anywhere from hundreds to millions of particles, with a strong focus on materials modeling, biomolecular simulations, and particle-based systems. While GROMACS is primarily tailored for biochemical molecules such as proteins, lipids, and nucleic acids—which often possess intricate bonded interactions—its exceptional speed in handling nonbonded interactions makes it advantageous for exploring non-biological systems, like polymers. The software adeptly models particle ensembles in a variety of states, including liquid, solid, and gas, and supports a wide range of molecular dynamics workflows, spanning from basic energy minimization and equilibration to comprehensive production simulations and trajectory analyses. As GROMACS develops, it continually integrates new features and improvements that expand its utility across various scientific fields, thereby enhancing researchers' ability to conduct complex simulations. This adaptability ensures that GROMACS remains a valuable resource for scientists exploring both biological and material systems.

Media

Media

Integrations Supported

Python

Integrations Supported

Python

API Availability

Has API

API Availability

Has API

Pricing Information

Free
Free Trial Offered?
Free Version

Pricing Information

Free
Free Trial Offered?
Free Version

Supported Platforms

SaaS
Android
iPhone
iPad
Windows
Mac
On-Prem
Chromebook
Linux

Supported Platforms

SaaS
Android
iPhone
iPad
Windows
Mac
On-Prem
Chromebook
Linux

Customer Service / Support

Standard Support
24 Hour Support
Web-Based Support

Customer Service / Support

Standard Support
24 Hour Support
Web-Based Support

Training Options

Documentation Hub
Webinars
Online Training
On-Site Training

Training Options

Documentation Hub
Webinars
Online Training
On-Site Training

Company Facts

Organization Name

National Energy Technology Laboratory

Company Location

United States

Company Website

mfix.netl.doe.gov/products/mfix/

Company Facts

Organization Name

GROMACS

Company Location

United States

Company Website

www.gromacs.org

Categories and Features

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