Tags: computational materials

All Categories (1-20 of 43)

  1. Dibya Prakash Rai

    http://nanohub.org/members/187116

  2. Muhammad Rashid

    Computational Material science and find the various properties using various DFT codes.

    http://nanohub.org/members/175317

  3. getahun walelign Ayele

    http://nanohub.org/members/156582

  4. Matthew Glen Robertson

    http://nanohub.org/members/149764

  5. ECE 595E Numerical Simulations for Energy Applications

    17 Jan 2013 | Courses | Contributor(s): Peter Bermel

    http://nanohub.org/resources/16570

  6. Application-driven Co-Design: Using Proxy Apps in the ASCR Materials Co-Design Center

    31 May 2012 | Online Presentations | Contributor(s): Jim Belak

    Computational materials science is performed with a suite of applications that span the quantum mechanics of interatomic bonding to the continuum mechanics of engineering problems and phenomenon...

    http://nanohub.org/resources/14149

  7. D Ray Johnson

    Retired from ORNL Materials Science and Technology Division after 37 years.

    http://nanohub.org/members/54782

  8. NCN, nanoHUB, HUBzero: cyberinfrastructure for nanotechnology

    10 Feb 2011 | Online Presentations | Contributor(s): Mark Lundstrom

    Presentation made at the Workshop to Develop the Global Nanotechnology Network, Grenoble, France.

    http://nanohub.org/resources/8996

  9. Goranka Bilalbegovic

    http://nanohub.org/members/45672

  10. Computer in Science Engineering: featuring nanoHUB.org

    22 Apr 2010 | Papers

    The current issue of Computing in Science and Engineering focuses on cyber-enabled nanotechnology, and nanoHUB.org is featured extensively throughout.

    http://nanohub.org/resources/8881

  11. Chunyu Li

    http://nanohub.org/members/34504

  12. Purdue School on High Performance and Parallel Computing

    24 Nov 2008 | Workshops | Contributor(s): Alejandro Strachan, Faisal Saied

    The goal of this workshop is to provide training in the area of high performance scientific computing for graduate students and researchers interested in scientific computing. The School will...

    http://nanohub.org/resources/5666

  13. Thermoelectric Power Factor Calculator for Nanocrystalline Composites

    21 Oct 2008 | Tools | Contributor(s): Terence Musho, Greg Walker

    Quantum Simulation of the Seebeck Coefficient and Electrical Conductivity in a 2D Nanocrystalline Composite Structure using Non-Equilibrium Green's Functions

    http://nanohub.org/resources/nccpf

  14. Northwestern University Initiative for Teaching Nanoscience

    20 Aug 2008 | Tools | Contributor(s): Baudilio Tejerina

    This package allows users to study and analyze of molecular properties using various electronic structure methods.

    http://nanohub.org/resources/nuitns

  15. Virtual Kinetics of Materials Laboratory: Spinodal Decomposition 3D

    15 Aug 2008 | Tools | Contributor(s): Michael Waters, R. Edwin García, Alex Bartol

    Simulates the Time-Dependent Segregation of Two Chemical Components

    http://nanohub.org/resources/vkmlsd3d

  16. Virtual Kinetics of Materials Laboratory : Spinodal Decomposition

    15 Aug 2008 | Tools | Contributor(s): Michael Waters, Alex Bartol, R. Edwin García

    Applies the Classic Cahn-Hilliard Equation to Simulate the Chemical Segregation of Two Phases (2D)

    http://nanohub.org/resources/vkmlsd

  17. Computational Nanoscience, Lecture 20: Quantum Monte Carlo, part I

    20 May 2008 | Teaching Materials | Contributor(s): Elif Ertekin, Jeffrey C Grossman

    This lecture provides and introduction to Quantum Monte Carlo methods. We review the concept of electron correlation and introduce Variational Monte Carlo methods as an approach to going beyond...

    http://nanohub.org/resources/4564

  18. Computational Nanoscience, Lecture 21: Quantum Monte Carlo, part II

    20 May 2008 | Teaching Materials | Contributor(s): Jeffrey C Grossman, Elif Ertekin

    This is our second lecture in a series on Quantum Monte Carlo methods. We describe the Diffusion Monte Carlo approach here, in which the approximation to the solution is not restricted by choice...

    http://nanohub.org/resources/4566

  19. Computational Nanoscience, Pop-Quiz

    20 May 2008 | Teaching Materials | Contributor(s): Elif Ertekin, Jeffrey C Grossman

    This quiz summarizes the most important concepts which have covered in class so far related to Molecular Dynamics, Classical Monte Carlo Methods, and Quantum Mechanical Methods.University of...

    http://nanohub.org/resources/4568

  20. Computational Nanoscience, Pop-Quiz Solutions

    20 May 2008 | Teaching Materials | Contributor(s): Elif Ertekin, Jeffrey C Grossman

    The solutions to the pop-quiz are given in this handout.University of California, Berkeley

    http://nanohub.org/resources/4570