Proof-of-Concept Modeling Environment for Nanoscale Materials

Introduction: MIC for Materials Science

The prototype modeling environment illustrated below will enable users to design new nanomaterials from the provided building blocks and composition rules, adjust their attributes, specify the kind of simulation, property analyses and visualization they desire, pick from the available target hardware platforms - the tool environment then will automatically assemble the necessary simulation and other software components, execute them on the appropriate available platform(s), store the results in the database and display them on the front-end.

Download Modeling and Simulation Materials

Simulation Modeling Screen Shots

Click on any of the following thumbnails to view the full-size image and read a brief description:


NBB Meta-Model                                                               Simulation Meta-Model

Simulation Models:

Example Simulation Model

Internal Model of an NBB Data Structure

Database Component Model