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This is a list of computer programs that are used to model nanostructures at the levels of classical mechanics and quantum mechanics. * Furiousatoms - a powerful software for molecular modelling and visualization * Aionics.io - a powerful platform for nanoscale modelling * 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 * JCMsuite – a finite element analysis software for simulating optical properties of nanostructures * LAMMPS – Open source molecular dynamics code * MA

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  • This is a list of computer programs that are used to model nanostructures at the levels of classical mechanics and quantum mechanics. * Furiousatoms - a powerful software for molecular modelling and visualization * Aionics.io - a powerful platform for nanoscale modelling * 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 * JCMsuite – a finite element analysis software for simulating optical properties of nanostructures * 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 , 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 (en)
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  • This is a list of computer programs that are used to model nanostructures at the levels of classical mechanics and quantum mechanics. * Furiousatoms - a powerful software for molecular modelling and visualization * Aionics.io - a powerful platform for nanoscale modelling * 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 * JCMsuite – a finite element analysis software for simulating optical properties of nanostructures * LAMMPS – Open source molecular dynamics code * MA (en)
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  • List of software for nanostructures modeling (en)
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