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All Categories (1-20 of 187)

1. 2010 NCN@Purdue Summer School: Electronics from the Bottom Up

   18 Jan 2011 |

   Electronics from the Bottom Up seeks to bring a new perspective to electronic devices – one that is designed to help realize the opportunities that nanotechnology presents.

2. 2016 Summer School for Integrated Computational Materials Education

   17 Jan 2017 | | Contributor(s):: Katsuyo Thornton

3. 3 min Research Talk: AFM And EBSD Cross-Comparison Analysis Tool

   31 Jan 2019 | | Contributor(s):: Andrew Martin Krawec

   This talk describes an approach to analyzing the crystal structure using data collected from AFM and EBSD scans to build an accurate image of the crystal structure and orientation in the ceramic

4. 3 min Research Talk: Analysis of Radiation Induced Segregation in Fe-Cr-Al Alloys

   31 Jan 2019 | | Contributor(s):: Timothy Joe Pownell

   This presentation gives an overview of the results and tool that were developed from data on Radiation Induced Segregation of the prospective cladding material Fe-Cr-Al.

5. 3 min Research Talk: Hierarchical Material Optimization using Neural Networks

   29 Oct 2019 | | Contributor(s):: Miguel Arcilla Cuaycong

   In this presentation, we sought to use a neural network (NN) to identify optimal arrangements of four different constituents in a tape spring to be used as snapping mechanisms in phase transforming cellular material that can dissipate energy.

6. 3 min Research Talk: Predicting and Optimizing Solar Cell Performance with Material/Surface Characteristics

   31 Jan 2019 | | Contributor(s):: Yiheng Zhu

   Photovoltaic simulation tools can be utilized to predict device performance before fabrication and experimentation, streamline research processes, and interpret experimental results. Therefore, we developed ContourPV, which simulates various combinations of values of different device...

7. 3 min. Research Talk: Identifying the Dimensionality of Crystal Structures

   12 Feb 2020 | | Contributor(s):: Franco Vera

   Today, researchers worldwide have identified over 100,000 distinct bulk materials. The underlying dimensionality of these materials is not always clear however, and as such researchers have sought to identify stable, lower dimensional materials derived from the bulk parent structures. A team of...

8. books on computational material science

   Q&A|Closed | Responses: 5

   which book is good for computational material science? Kindly suggest me which are all to be referred for computational material science.

   https://nanohub.org/answers/question/569

9. A Condensed Matter Physics class and a Course-Based Undergraduate Research Experience (CURE) with the MIT Atomic-Scale Modeling Toolkit

   07 Nov 2022 | | Contributor(s):: David Strubbe

   In this presentation, Dr. Strubbe will discuss how he has been using the MIT Atomic-Scale Modeling Toolkit as a part of his undergraduate and graduate class on condensed matter physics. In discussion sections, simulations are performed to illustrate concepts like covalent bonding,...

10. ab initio simulations with ORCA

    28 Jul 2015 | | Contributor(s):: nicolas onofrio, Alejandro Strachan

    ab initio and density functional theory calculations dedicated to molecular systems

11. ABINIT

    13 May 2004 | | Contributor(s):: Amritanshu Palaria, Xufeng Wang, Benjamin P Haley, Matteo Mannino, Gerhard Klimeck

    Run the community code ABINIT for electronic structure calculations under density functional theory through a convenient graphical user interface

12. 

    Adam Powell

    Adam Powell is an Associate Professor in the Mechanical Engineering department at WPI. Research interest: using materials processing, particularly the tools of electrochemistry and process...

    https://nanohub.org/members/34510

13. Additional Tutorials on Selected Topics in Nanotechnology

    23 Mar 2011 | | Contributor(s):: Gerhard Klimeck, Umesh V. Waghmare, Timothy S Fisher, N. S. Vidhyadhiraja

    Select tutorials in nanotechnology, a part of the 2010 NCN@Purdue Summer School: Electronics from the Bottom Up.

14. Adsorption Energy Calculator

    18 Aug 2019 | | Contributor(s):: Julian C Umeh, Thomas A Manz

    Calculate the total energy of adsorbates as they move around a metal organic framework

15. AIDA: A tool for exhaustive enumeration of solutions to the quantized Frank-Bilby equation

    05 Jan 2018 | | Contributor(s):: Ali Sangghaleh, Michael J. Demkowicz

    We present a tool called Arrangement of Interface Dislocation Arrays (AIDA) for enumerating all dislocation networks that satisfy the quantized Frank-Bilby equation for any interface between cubic crystals with a single-atom basis, i.e. FCC/FCC, BCC/BCC, and FCC/BCC interfaces. The set of...

16. 

    Akshat Saraf

    Chemistry PhD Student at Georg August Universität GöttingenUsing computational chemistry to better inform electrochemical experiments

    https://nanohub.org/members/190860

17. An Introduction to Finite Element Analysis of Material Microstructure Properties in nanoHUB

    14 Sep 2023 | | Contributor(s):: Yang Dan

    In this webinar, Yang will give a brief introduction to the fundamentals of FEA and OOF2, and demonstrate OOF2 simulations of stress distribution in example materials, with and without temperature effect.

18. 

    Andrés Felipe Sierra

    BSc Chemical Engineering & Data Scientist. Materials Science and Nanotech enthusiasm.

    https://nanohub.org/members/344047

19. 

    Angelo Giovanni Oñate Soto

    Angelo Oñate Soto is a member of the Department of Mechanical Engineering of the Universidad del Bío Bío. He is a Mechanical Engineer and has a degree in Engineering Sciences from the Universidad...

    https://nanohub.org/members/280252

20. 

    Anter A El-azab

    Dr. El-Azab is a professor of Materials Science and Engineering at Purdue University. His research interests are in the broad area of microstructure science. His current research includes mesoscale...

    https://nanohub.org/members/186519