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List of Software For Nanostructures Modelingreport

  • Ascalaph Designer

  • Atomistix ToolKit and Virtual NanoLab

  • CoNTub

  • CP2K

  • CST Studio Suite

  • Deneb – graphical user interface (GUI) for SIESTA, VASP, QE, etc., DFT calculation packages

  • Exabyte.io - a cloud-native integrated platform for nanoscale modeling, supporting simulations at multiple scales, including Density Functional Theory and Molecular Dynamics

  • LAMMPS – Open source molecular dynamics code

  • MAPS - Graphical user interface to build complex systems (nanostructures, polymers, surfaces...), set up and analyze ab-initio (Quantum Espresso, VASP, Abinit, NWChem...) or classical (LAMMPS, Towhee) simulations

  • nanoHUB allows simulating geometry, electronic properties and electrical transport phenomena in various nanostructures

  • Ninithi – carbon nanotube, graphene, and Fullerene modelling software

  • Nanoengineer-1 – developed by company Nanorex, but the website doesn't work, may be unavailable

  • NEMO 3-D – enables multi-million atom electronic structure simulations in empirical tight binding; open source; an educational version is on nanoHUB and Quantum Dot Lab

  • Nanotube Modeler

  • Materials Design MedeA

  • Materials Studio

  • Materials Square - a cloud-based materials simulation web platform, provides GUI for Quantum Espresso, LAMMPS, and Open Calphad

  • MBN Explorer and MBN Studio

  • MD-kMC

  • PARCAS – Open source molecular dynamics code

  • SAMSON: interactive carbon nanotube modeling and simulation

  • Scigress

  • TubeASP

  • Tubegen

  • Wrapping

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About This Tool

Since the appearance of carbon nanotubes (cnts) , there has been a worldwide upsurge in the study of nanomaterials. It has attracted a great deal of interest in materials science over the past decade, not only because of its unique and fascinating properties, but also because these properties change with the size and morphology of nanomaterials. To help modeling nanostructures run more smoothly, the tool generates a list of 25 computer programs designed to help model them better.

When you randomly look at the specific software information in this list, you can see that the commonalities are used to model nanostructures at both the classical and quantum mechanical levels, and through the simulation of 3D modeling to build a small scale model structure. This has the advantage of allowing scientists to see as much of the physical form as possible, and what needs to be added or subtracted from the construction process on the ground, at a cost and material savings.

Click the "Display All Items" button and you will get a list of software for nanostructures modeling.

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