List of software for nanostructures modeling
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This is a list of computer programs that are used to model nanostructures at the levels of classical mechanics[1] and quantum mechanics.
- Furiousatoms[2] - a powerful software for molecular modelling and visualization
- Aionics.io[3] - a powerful platform for nanoscale modelling
- Ascalaph Designer
- Atomistix ToolKit and Virtual NanoLab[4]
- CoNTub
- CP2K
- CST Studio Suite[5]
- Deneb[6] – graphical user interface (GUI) for SIESTA, VASP, QE, etc., DFT calculation packages
- 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.
- Exabyte.io[7] - a cloud-native integrated platform for nanoscale modeling, supporting simulations at multiple scales, including Density Functional Theory and Molecular Dynamics
- finite element analysissoftware 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[8] – developed by company Nanorex, but the website doesn't work, may be unavailable
- NEMO 3-D[9] – enables multi-million atom electronic structure simulations in empirical tight binding; open source; an educational version is on nanoHUB and Quantum Dot Lab[10]
- Nanotube Modeler[11]
- Materials Design MedeA[12]
- Materials Studio
- Materials SquareCalphad
- MBN Explorer and MBN Studio[14][15]
- MD-kMC[16]
- PARCAS[17][18][19] – Open source molecular dynamics code
- SAMSON: interactive carbon nanotube modeling[20] and simulation[21]
- Scigress
- TubeASP[22]
- Tubegen[23]
- Wrapping[24]
See also
- List of quantum chemistry and solid state physics software
- Comparison of software for molecular mechanics modeling
- Comparison of nucleic acid simulation software
- Molecular design software
- Molecule editor
- Carbon nanotube
- Boron nitride nanotube
- Graphene
References
- doi:10.1016/S0010-4655(02)00432-0. Archived from the original(PDF) on 27 June 2008.
- ^ "FURIOUSATOMS". furiousatoms.com. Retrieved 2022-04-08.
- ^ Aionics
- S2CID 44943573.)
{{cite journal}}
: CS1 maint: multiple names: authors list (link - ^ CST Studio Suite
- ^ Deneb
- ^ Exabyte
- ^ Nanoengineer-1 Archived 2015-08-01 at the Wayback Machine
- ^ NEMO 3-D
- ^ Quantum Dot Lab
- ^ Nanotube Modeler
- ^ Materials Design MedeA
- ^ Materials Square
- ISBN 978-3-319-56085-4.
- ^ "MBN Explorer and MBN Studio software".
- ^ MD-kMC
- .
- ISSN 0141-8610.
- ISSN 0927-0256.
- ^ SAMSON Element: Nanotube creator
- ^ SAMSON Element: Brenner interaction model
- ^ TubeASP
- ^ Tubegen
- ^ Wrapping