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nmarcella/README.md

Hi there 👋

My name is Nick, and I'm a postdoctoral research associate at the University of Illinois Urbana-Champaign and Brookhaven National Lab. I'm interested in developing solutions to fun materials science problems with Python!

  • 🔭 I’m currently working on machine learning models for analyzing X-ray spectroscopy data, methods for automating theoretical X-ray calculations, and OVITO-based methods for extracting useful parameters from molecular dynamics simulations of nanoparticles. 🌱 I’m currently learning how to optimize code for deployment on high-performance clusters, and I'm also improving my AI skills.
  • ✨ Until recently, most of my coding work was done on my local computer. I intend to use Github more regularly in the coming months as I incorporate Git into my project management workflow.

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  1. AI_projects AI_projects Public

    I'm using this repo to improve my AI skills.

    Jupyter Notebook

  2. Multi_dataset_fitting_larch Multi_dataset_fitting_larch Public

    Python

  3. Surge Surge Public

    A repo for demonstrating the efficacy of NN surrogate models for XAS simulation

    Jupyter Notebook 1