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Tools (1-20 of 21)

1. MD simulations of shock loading

   0.0 out of 5 stars 

   29 Dec 2015 | Tools | Contributor(s): edwin alberto antillon, Mitchell Anthony Wood, Mathew Joseph Cherukara, Alejandro Strachan

   Use MD simulation to study shocks in various materials including metals and energetics

   https://nanohub.org/resources/mdshocks

2. Molecular Exploration Tool

   0.0 out of 5 stars 

   10 Dec 2015 | Tools | Contributor(s): Xueying Wang, nicolas onofrio, Alejandro Strachan, David M Guzman

   The tool can display the molecule structures and run Lammps simulations.

   https://nanohub.org/resources/molexpl

3. Molecular Dynamics Showcase Builder

   0.0 out of 5 stars 

   09 Nov 2015 | Tools | Contributor(s): Michael McLennan, Nicholas K Kisseberth, George A. Howlett, Jim Slopsema, Aleksei Aksimentiev, Chen-Yu Li

   Tool to create showcases for the Molecular Dynamics Showcase viewer.

   https://nanohub.org/resources/mdshowbuilder

4. Nanomaterial Mechanics Explorer

   5.0 out of 5 stars 

   19 Aug 2015 | Tools | Contributor(s): Michael N Sakano, shuhui tang, Alexis Belessiotis, Christopher Chow, Sam Reeve, Mitchell Anthony Wood, Kiettipong Banlusan, Alejandro Strachan

   Simulate dislocation dynamics, crack propagation, nanowire tensile tests, and phase transitions

   https://nanohub.org/resources/nanomatmech

5. Crack Propagation Simulation

   0.0 out of 5 stars 

   13 Mar 2015 | Tools | Contributor(s): hojin kim, Nilofer Rajpurkar, Benjamin P Haley, Alejandro Strachan

   Simulate crack propagations through materials under applied loads.

   https://nanohub.org/resources/crackpropsim

6. Molecular Dynamics Showcase

   0.0 out of 5 stars 

   14 Oct 2013 | Tools | Contributor(s): Michael McLennan, Chen-Yu Li, john stone, Aleksei Aksimentiev, George A. Howlett

   View interesting features of a molecular dynamics trajectory file

   https://nanohub.org/resources/mdshowcase

7. Crystalline Cellulose - Atomistic Toolkit

   0.0 out of 5 stars 

   05 Aug 2013 | Tools | Contributor(s): Mateo Gómez Zuluaga, Robert J. Moon, Fernando Luis Dri, Pablo Daniel Zavattieri

   Crystalline Cellulose - Atomistic Toolkit

   https://nanohub.org/resources/ccamt

8. 2d Ideal Gas Molecular Dynamics

   0.0 out of 5 stars 

   27 Sep 2011 | Tools | Contributor(s): Terence Musho, Greg Walker

   Simulation of a 2d molecular gas with specified temperature boundary conditions

   https://nanohub.org/resources/smdc

9. 1-D Chain Dispersions

   0.0 out of 5 stars 

   23 Sep 2011 | Tools | Contributor(s): Nicholas Roberts, Greg Walker

   1-D Chain of atoms, bases and layers to produce phonon dispersion

   https://nanohub.org/resources/1dchainmd

10. Temperature Accelerated Dynamics

    0.0 out of 5 stars 

    13 Sep 2011 | Tools | Contributor(s): Justin Riley, Markus J. Buehler

    Simulate temperature accelerated dynamics

    https://nanohub.org/resources/tad

11. nanoMATERIALS nanoscale heat transport

    0.0 out of 5 stars 

    31 Aug 2011 | Tools | Contributor(s): Keng-Hua Lin, Sean Sullivan, Mathew Joseph Cherukara, Alejandro Strachan, Tianli Feng, Xiulin Ruan, Bo Qiu

    Non-equilibrium MD simulations of heat transport in nano-materials

    https://nanohub.org/resources/nmstthermal

12. MiniMol: Minimal Molecular Simulation Tool

    0.0 out of 5 stars 

    15 Aug 2011 | Tools | Contributor(s): Ellad B Tadmor, Ron Earle Miller, Ryan S Elliott

    Perform simple molecular dynamics and statics simulations.

    https://nanohub.org/resources/minimol

13. Polymer Modeler

    3.5 out of 5 stars 

    25 Aug 2010 | Tools | Contributor(s): Benjamin P Haley, Nate Wilson, Chunyu Li, Andrea Arguelles, Eugenio Jaramillo, Alejandro Strachan

    Build thermoplastic polymer chains and run LAMMPS to relax the chains and study mechanical properties

    https://nanohub.org/resources/polymod

14. Atomic Stick-Slip

    0.0 out of 5 stars 

    31 Mar 2010 | Tools | Contributor(s): Ashlie Martini, Jianguo Wu

    Molecular dynamics simulation of atomic stick-slip friction

    https://nanohub.org/resources/stickslip

15. MIT Tools for Energy Conversion and Storage

    0.0 out of 5 stars 

    12 Oct 2009 | Tools | Contributor(s): Jeffrey C Grossman, Joo-Hyoung Lee, Varadharajan Srinivasan, Alexander S McLeod, Lucas Wagner

    Atomic-Scale Simulation Tools to Explore Energy Conversion and Storage Materials

    https://nanohub.org/resources/nanoenergytools

16. MD Simulation

    5.0 out of 5 stars 

    31 Mar 2008 | Tools | Contributor(s): Sanket S Mahajan, Ganesh Subbarayan, Xufeng Wang

    Code to perform Molecular Dynamics (MD) Simulations

    https://nanohub.org/resources/mdsim

17. BioMOCA Suite

    4.0 out of 5 stars 

    14 Feb 2008 | Tools | Contributor(s): David Papke, Reza Toghraee, Umberto Ravaioli, Ankit Raj

    Simulates ion flow through a channel.

    https://nanohub.org/resources/BMCsuite

18. Nano Heatflow

    0.0 out of 5 stars 

    17 Dec 2007 | Tools | Contributor(s): Joe Ringgenberg, P. Alex Greaney, daniel richards, Jeffrey C Grossman, Jeffrey B. Neaton, Justin Riley

    Study the transfer of energy between the vibrational modes of a carbon nanotube.

    https://nanohub.org/resources/nanoheatflow

19. REBO

    4.0 out of 5 stars 

    02 Oct 2006 | Tools | Contributor(s): Wen-Dung Hsu, SeongJun Heo, Jing Xu, Susan Sinnott

    Reactive Empirical Bond-Order (REBO) potential is a many-body expression optimized for modeling covalently bonded materials, such as carbon and silicon, in large-scale atomistic simulations

    https://nanohub.org/resources/rebomd

20. Micelle

    0.0 out of 5 stars 

    21 Sep 2006 | Tools | Contributor(s): Kunal Shah, Patrick Chiu, Jing Xu, Susan Sinnott

    Parallel Molecular Dynamics (MD) code that models surfactant structures in water and at liquid/solid interfaces.

    https://nanohub.org/resources/micelle