iGRAF
iGRAF is an integrated powder and multiphase flow simulation tool that seamlessly merges the domains of powder and fluid simulation. It is designed as a one-stop solution for replicating a wide variety of powder behaviors and redefining standards in simulation technology. iGRAF’s integrated DEM-CFD solver enables accurate and efficient analysis of single-phase and multiphase flow, helping users understand particle-fluid interactions in one platform. Its dynamic geometry control supports translations, rotations, vibrations, and user-defined motion, allowing teams to precisely capture the dynamics of complex systems. It includes validated liquid bridging models and van der Waals forces to analyze the influence of moisture and adhesion on particle behavior, with its liquid bridge force model extensively validated up to 15% moisture content. iGRAF also combines the Signed Distance Function and Immersed Boundary Method to recognize arbitrary solid geometries.
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Yade
Yade is an extensible open source framework for discrete numerical models, focused on the Discrete Element Method. Its computation parts are written in C++ using a flexible object model that allows independent implementation of new algorithms and interfaces, while Python is used for rapid and concise scene construction, simulation control, postprocessing, and debugging. Yade is designed for researchers and engineers who need to create, run, inspect, modify, and extend particle-based simulations through scripts, interactive commands, graphical tools, and reusable simulation components. Simulations can be built from specialized generators or constructed directly with Python scripts, giving users flexibility for developing custom models, importing geometries, reusing code, and controlling the full simulation loop. It represents each simulation as a scene containing bodies, interactions, and resultant forces, with bodies defined by geometry, material properties, state variables, etc.
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MFiX
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.
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XPS (eXtended Particle Simulations)
XPS, or eXtended Particle Simulations, is a state-of-the-art Discrete Element Method simulation software developed by RCPE and distributed globally by InSilicoTrials for high-fidelity particle-based process simulation. Designed specifically for pharmaceutical applications, XPS accurately predicts powder and granular behavior, helping teams better understand, predict, and control pharmaceutical unit operations. It relies on advanced contact models to describe the flow behavior of granular materials and uses massively parallel algorithms optimized for modern GPUs to accelerate simulations, including simulations with up to 100 million particles. XPS helps pharmaceutical engineers assess process configurations in unprecedented detail, explore decision space virtually, reduce costly and time-consuming physical experiments, and support data-driven process development.
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