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List of software for nanostructures modeling
open-in-new
<p>This is a list of notable computer programs that are used to model <a href="/facts/Nanostructure/rkeQGqt7">nanostructures</a> at the levels of <a href="/facts/Classical_mechanics/ykG8upsN">classical mechanics</a> and <a href="/facts/Quantum_mechanics/BRc3Mzgr">quantum mechanics</a>. </p> <ul><li>Furiousatoms - a powerful software for molecular modelling and visualization</li> <li>Aionics.io - a powerful platform for nanoscale modelling</li> <li><a href="/facts/Ascalaph_Designer/GJnlfVQq">Ascalaph Designer</a></li> <li><a href="/facts/Atomistix_ToolKit/YyC1XXpu">Atomistix ToolKit</a> and <a href="/facts/Atomistix_Virtual_NanoLab/yUoIk3ep">Virtual NanoLab</a></li> <li><a href="/facts/CoNTub/xFE9ExvY">CoNTub</a></li> <li><a href="/facts/CP2K/g84Xktgq">CP2K</a></li> <li><a href="/facts/CST_Studio_Suite/sqnFqn6h">CST Studio Suite</a></li> <li><a href="/facts/Deneb/L7dTfcog">Deneb</a> – graphical user interface (GUI) for SIESTA, VASP, QE, etc., DFT calculation packages</li> <li>Enalos Cloud Platform – a cloud platform containing tools for the digital construction of energy minimized nanotubes and ellipsoidal nanoparticles and the calculation of their atomistic descriptors.</li> <li>Exabyte.io - a cloud-native integrated platform for nanoscale modeling, supporting simulations at multiple scales, including <a href="/facts/Density_functional_theory/wwz4Gqdg">Density Functional Theory</a> and <a href="/facts/Molecular_dynamics/yR3DNt6U">Molecular Dynamics</a></li> <li><a href="/facts/JCMsuite/MxsaBaVK">JCMsuite</a> – a <a href="/facts/Finite_element_analysis/eUcfP1vn">finite element analysis</a> software for simulating optical properties of nanostructures</li> <li><a href="/facts/LAMMPS/DgKHIKCw">LAMMPS</a> – Open source <a href="/facts/Molecular_dynamics/yR3DNt6U">molecular dynamics</a> code</li> <li>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</li> <li>Nanoengineer-1 – developed by company Nanorex, but the website doesn't work, may be unavailable</li> <li><a href="/facts/NanoHUB/xarF5ptQ">nanoHUB</a> allows simulating geometry, electronic properties and electrical transport phenomena in various nanostructures</li> <li>Nanotube Modeler</li> <li>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</li> <li>nextnano allows simulating geometry, electronic properties and electrical transport phenomena in various nanostructures using continuum models (commercial software)</li> <li><a href="/facts/Ninithi/l6jTkgep">Ninithi</a> – carbon nanotube, graphene, and Fullerene modelling software</li> <li>Materials Design MedeA</li> <li><a href="/facts/Materials_Studio/f7xr8Svp">Materials Studio</a></li> <li>Materials Square - a cloud-based materials simulation web platform, provides GUI for Quantum Espresso, <a href="/facts/LAMMPS/DgKHIKCw">LAMMPS</a>, and Open <a href="/facts/Calphad/mxyznjvc">Calphad</a></li> <li><a href="/facts/MBN_Explorer/RN9rBNFH">MBN Explorer</a> and MBN Studio</li> <li>MD-kMC</li> <li>PARCAS – Open source <a href="/facts/Molecular_dynamics/yR3DNt6U">molecular dynamics</a> code</li> <li><a href="/facts/SAMSON/YQltsErB">SAMSON</a>: interactive carbon nanotube modeling and simulation</li> <li><a href="/facts/Scigress/za3SYQPB">Scigress</a></li> <li>TubeASP</li> <li>Tubegen</li> <li>Wrapping</li></ul>