Coarse Graining of Crystalline Cellulose
29 Jul 2016 | | Contributor(s):: Kuo Tian, Mehdi Shishehbor, Pablo Daniel Zavattieri
Bio-inspired Crystalline Nano-Cellulose coarse graining toolkit
NEMO5 and 2D Materials: Tuning Bandstructures, Wave Functions and Electrostatic Screening
18 Oct 2016 | | Contributor(s):: Tillmann Christoph Kubis
In this talk, I will briefly discuss the MLWF approach and compare it to DFT and atomistic tight binding. Initial results using the MLWF approach for 2D material based devices will be discussed and compared to experiments. These results unveil systematic band structure changes as functions of the...
NEMO5, a Parallel, Multiscale, Multiphysics Nanoelectronics Modeling Tool
16 Sep 2016 | | Contributor(s):: Gerhard Klimeck
The Nanoelectronic Modeling tool suite NEMO5 is aimed to comprehend the critical multi-scale, multi-physics phenomena and deliver results to engineers, scientists, and students through efficient computational approaches. NEMO5’s general software framework easily includes any kind of...
A Gentle Introduction to Uncertainty Quantification
19 Aug 2016 | | Contributor(s):: Ilias Bilionis
Surprising Nanophotonic Phenomena in Nature and Photonic Modeling with S4
13 Jul 2016 | | Contributor(s):: Peter Bermel
I will show how S4sim, a transfer matrix-based optical simulation tool available on nanoHUB.org can be used to precisely calculate these behaviors. A few exciting real-world applications of this work will also be briefly discussed.
Surprising Nanophotonic Phenomena in Nature
11 Jul 2016 | | Contributor(s):: Peter Bermel
A broad range of optical phenomena in nature have created long-standing mysteries. For example, what gives butterflies and birds their rich colors? And how can sightings of some unusual natural phenomena like mirages or ball lightning be explained? The process of solving these mysteries has...
Exploring Materials Properties with Nanomaterial Mechanics Explorer Structure Files
24 Mar 2016 | | Contributor(s):: Tanya Faltens
This document describes how to generate and download simulation output files from the Nanomaterial Mechanics Explorer on nanoHUB and view them locally using OVITO.This can be particularly useful for more advanced manipulations of the trajectory files, and for sharing files with others, such...
OOMMF FTUG: Object Oriented MicroMagnetic Framework First Time User's Guide
OOMMF is the Object Oriented MicroMagnetic Framework, which is a powerful research-grade simulation tool for modeling the response of materials to applied magnetic fields that was developed by Dr.s Mike Donahue and Don Porter in the Information Technology Laboratory at the National Institute of...
Nanomechanics Simulation Tool: Dislocations Make or Break Materials
16 Mar 2016 | | Contributor(s):: Michael N Sakano
The goal of computational material science is to improve existing materials and design new ones through mathematical calculations. In particular, molecular dynamic simulations can allow for visualization of dislocations in a material, along with its resulting behavior when under stress. For...
nanoHUB Used in Research: A One Developer/User View
18 Feb 2016 | | Contributor(s):: Dragica Vasileska
In this presentation I will give overview of selected nanoHUB tools and their potential for performing state- of-the-art research. The tools selected for this purpose include SCHRED, QuaMC2D, and OMEN nanowire/ NEMO5. ...
A Massively Parallel Semicoarsening Multigrid for 3D Reservoir Simulation on Multi-core and Multi-GPU Architectures
04 Feb 2016 | | Contributor(s):: Abdulrahman Manea
In this work, we have designed and implemented a massively parallel version of the Semicoarsening Black Box Multigrid Solver , which is capable of handling highly heterogeneous and anisotropic 3D reservoirs, on a parallel architecture with multiple GPU’s. For comparison purposes, the...
nanoHUB: Cloud Scientific Computing in Materials Education and Research
22 Jan 2016 | | Contributor(s):: Alejandro Strachan
nanoHUB’s cyber-infrastructure empowers simulation tool developers to make their codes universally accessible and useful via cloud computing and empowers users who can run hundreds of tools using a web-browser or tablet, free of charge, and without the need to download or install any...
Photovoltaics QCRF-FDTD Simulator
15 Oct 2015 | | Contributor(s):: Jacob R Duritsch, Haejun Chung, Peter Bermel
Simulates optical and electrical behaviors of photovoltaic cells using a FDTD simulation method and QCRF material modeling.
Sep 02 2015
18th International Workshop on Computational Electronics
Atomistic Simulations of Materials Chemistry: From Nanoelectronics to Energetics
06 Apr 2015 | | Contributor(s):: Alejandro Strachan
Presentation slides with embedded videos are available for download. Please see the Support Docs tab.
HUBzero: A Platform for Scientific Research, Education, and Collaboration
11 Mar 2015 | | Contributor(s):: Michael McLennan
HUBzero® is an open source software platform used to build web sites for collaboration in an academic setting. HUBzero supports data management, computation, and the natural synergy between education and research. This talk gives an overview of the platform, showing how it...
Uso de simulaciones en investigación y educación en ciencia e ingeniería
16 Mar 2015 | | Contributor(s):: Alejandro Strachan
En una colaboración entre la Escuela de Ingeniería de EAFIT, el Centro de Computación Científica Apolo y Proyecto 50, recibimos a Alejandro Strachan, profesor de la Universidad de Purdue, quien nos dio la oportunidad de reflexionar sobre qué es una...
Taohid Bin Nur Tusher
Mathematical Models and Simulations Workshop Presentation
09 Mar 2015 | | Contributor(s):: Kelsey Joy Rodgers, Heidi A Diefes-Dux, Krishna Madhavan, Yi Kong
Developing engineers for a changing world presents a greater need for students to understand simulations. Understanding mathematical models and simulations are skills that all engineers need for industry and research, but many engineering students lack a conceptual understanding of how to develop...