All Categories (1-7 of 7)

1. ICMEd 2024 Kinetic Monte Carlo Module

   Teaching Materials | 08 Aug 2024 | Contributor(s):: ICMEd Summer School

   This Kinetic Monte Carlo (KMC) Module from the ICMEd Summer School Contains: KMC Lecture KMC Walkthrough KMC notebook .ipynb file (can be run in nanoHUB using Jupyter Notebooks) Canonical MC notebook .ipynb file (can be run in nanoHUB using Jupyter Notebooks) KMC Problem...

2. 

   Peter Koval

   https://nanohub.org/members/215617

3. PREPRINT: Molecular Modeling of the Microstructure Evolution during the Carbonization of PAN-Based Carbon Fibers

   Papers | 23 Mar 2017 | Contributor(s):: Alejandro Strachan, Saaketh Desai

   PREPRINTDevelopment of high strength carbon fibers (CFs) requires an understanding of the relationship between the processing conditions, microstructure and resulting properties. We developed a molecular model that combines kinetic Monte Carlo (KMC) and molecular dynamics (MD) techniques to...

4. Bulk Heterojunction Morphology Generator

   Tools | 11 Feb 2013 | Contributor(s):: Michael C. Heiber

   This tool creates nanoscale bulk heterojunction morphologies for use with organic photovoltaics simulations

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   Srinath Chakravarthy

   https://nanohub.org/members/77396

6. 

   Miguel Angel Gosalvez

   Miguel A. Gosálvez received the M.S. degree (licentiate) in Material Physics in 1996 from Universidad Complutense de Madrid, Spain, and the Ph.D. degree in Computational Physics from Helsinki...

   https://nanohub.org/members/69121

7. 

   Darwin Barayang Putungan

   https://nanohub.org/members/43753