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All Categories (1-20 of 20)

1. nanoHUB - Your Solution to FAIR Data Challenges

   Online Presentations | 20 Jun 2024 | Contributor(s):: Michael Zentner, Alejandro Strachan

   This short video introduces how nanoHUB can help those in the science community meet the challenges of making their data findable, accessible, interoperable, and reproducible (FAIR). ...

2. Perovskite VASP-Data Extractor

   Tools | 25 Mar 2024 | Contributor(s):: Rushik Desai, Alejandro Strachan, Arun Kumar Mannodi Kanakkithodi

   This tool would be used to extract important data from a perovskite VASP DFT run and store it on a queryable database.

3. Simple Quantum Dot Lab (Web Interactive Front End)

   Tools | 08 Jan 2024 | Contributor(s):: Daniel Mejia, Gerhard Klimeck

   Compute the eigenstates of a particle in a box of various shapes including domes and pyramids

4. Crystal Viewer App (Web Interactive Front End)

   Tools | 17 Mar 2023 | Contributor(s):: Daniel Mejia, Gerhard Klimeck

   Simtool Crystal viewer

5. VASP ingestor

   Tools | 20 Feb 2023 | Contributor(s):: Kat Nykiel, Alejandro Strachan

   Convert an atomate2 TaskDocument of VASP data to an interpretable set of features

6. nanoHUB Guide for Developers: Sim2Ls FAIR Workflows and Data

   Presentation Materials | 07 Feb 2023 | Contributor(s):: Alejandro Strachan

   This presentation is part of the short course "Getting Started Guide for nanoHUB Tool and App Developers" which covers the following topics:Why publish tools & apps in nanoHUB?Various tool and app typesSim2Ls: FAIR workflows and dataApp...

7. Sim2L Results Explorer

   Tools | 06 Feb 2023 | Contributor(s):: Juan Carlos Verduzco Gastelum, Alejandro Strachan

   GUI for exploration of sim2l results in our resultsDB, allows for simple visualizations and query generation

8. Piece-Wise Constant Potential Barrier Sim2L

   Tools | 01 Feb 2023 | Contributor(s):: Daniel Mejia

   Piece-Wise Constant Potential Barrier simulation using sim2l infrastructure

9. How to create a Sim2L

   Online Presentations | 15 Sep 2022 | Contributor(s):: Daniel Mejia, Alan Ian Zhang

   Video tutorials on Sim2L building

10. PyOxidation

    Tools | 08 Aug 2022 | Contributor(s):: Noah Bradley Hallberg, Michael S Titus, Saswat Mishra

    Predicts high-temperature oxidation behavior of refractory alloys

11. ANN Model Generator

    Tools | 11 Jul 2022 | Contributor(s):: Juan Carlos Verduzco Gastelum, Alejandro Strachan

    Simtool workflow to create ANN models for user datasets

12. Single Gate Moscap

    Tools | 24 May 2022 | Contributor(s):: Daniel Mejia, Darin Tsai, Alan Ian Zhang, Aloysius Brave Rebeiro

    Simtool to simulate single Gate Moscap

13. Visualization Dashboard for MPCAs

    Tools | 09 Mar 2022 | Contributor(s):: Juan Carlos Verduzco Gastelum, Zachary D McClure, Alejandro Strachan

    Sim2L Visualization Dashboard for Multi-Principal Component Allloys

14. Gateways 2021 Tutorial: SimTools—Software tools that are FAIR

    Online Presentations | 07 Dec 2021 | Contributor(s):: Steven Clark, Daniel Mejia, Alejandro Strachan

    In this tutorial, we will walk attendees through how SimTools operate within the nanoHUB.org gateway. In a 90-minute session designed for beginners, attendees will create an account on nanoHUB to complete hands-on activities during the tutorial. Some experience with Python is preferred.

15. Caesar Cipher

    Tools | 22 Oct 2021 | Contributor(s):: Darin Tsai, Alan Ian Zhang

    Caesar Cipher with 2 additional outputs (Vip project)

16. SimTools: Delivering Simulations in the Era of Abundant Data

    Online Presentations | 04 Jun 2021 | Contributor(s):: Alejandro Strachan

    This presentation introduces SimTool, a library that allows developers to create, publish, and share reproducible workflows with well-defined and verified inputs and outputs.

17. pntoy using simtool infrastructure

    Tools | 02 Feb 2021 | Contributor(s):: Daniel Mejia

    PNJunction Simtool

18. Introduction to Sim2Ls

    Tools | 22 Apr 2020 | Contributor(s):: Saaketh Desai, Steven Clark, Alejandro Strachan

    Learn about Sim2Ls - a product to deliver simulations with validated inputs, outputs and simulation caching in nanoHUB

19. Melting point simulation using OpenKIM

    Tools | 22 Mar 2019 | Contributor(s):: Martin Hunt, Alejandro Strachan, Saaketh Desai

    Computes melting point using a coexistence technique using interatomic potentials from OpenKIM

20. QDOT Jupyter Test

    Tools | 29 Jan 2019 | Contributor(s):: Martin Hunt

    a test and demo of the qdot tool ported to Jupyter