MAPS is a comprehensive software platform incorporating the workflowĮmpowers users with an efficient and seamless way to model complex Other powerful functionalities for calculating key properties such as To create input geometries for LAMMPS plus tools to analyze the Modeling and coarse grain modeling) with LAMMPS. MAPS also has a number of forcefields to choose from (for atomistic Visualize and perform analysis on the output from LAMMPS simulations. Within MAPS also allow users to create input files for LAMMPS,
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Scienomics provides full phone and email support for Interface to LAMMPS as part of their Materials and ProcessesĪllows both novice LAMMPS users and experts to quickly and efficientlyĬreate LAMMPS input files - for both atomistic and DPD Has an established track record in the development of accurateįorcefields for organic and metallic systems. Organic, inorganic, and metallic systems the Materials Design team MedeA® alsoįacilitates the management of forcefields for the simulation of
Including elastic constants, diffusivity, transport properties andĬohesive energies based on LAMMPS simulations. Provide validated methods for the prediction of mechanical properties, Methods for crystalline systems, and with the MedeA®īuilders, which are tools to create input for LAMMPS. With MedeA®, atomistic models may be constructed using a variety of Resulting LAMMPS simulations are easily shared among colleagues,Įdited for future reuse, and can be customized by LAMMPS experts. Simulation protocols using simple discrete LAMMPS stages. Simulations with flowcharts that allow you to assemble complex Modeling environment that provides productivity, model building andĪnalysis tools for use with LAMMPS. develops MedeA®, an atomistic simulation and Running simulations, and analyzing the results. LAMMPS to provide a user-friendly environment for developing models, This section describes both commercial and free software that wraps GUI and Analysis Software that wraps LAMMPS Orsi group at Queen Mary University of London.JARVIS database for MD potential calculations on DFT geometries.Automated Topology Builder (ATB) and Repositoryĭata Sites - website with data useable as LAMMPS input.Molecular Simulation Design Framework (MoSDeF).Molecular Builders - software to build or convert GUI and Analysis Software - commercial and free software that If you want to add something to the list. We are happy to advertise software and dataĪrchives here, so that LAMMPS users can try it out. They extend the scope of problems that LAMMPS can modelĪnd its ease of use. We think hese kinds of tools, whether freeware or commercial, can be This page gives pointers to various software tools, data repositories,Īnd books which can be used in conjunction with LAMMPS.
Pre/Post Processing Tools for use with LAMMPS
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