Skip to content
View diegonti's full-sized avatar
:electron:
:electron:
32 followers · 38 following

Achievements

Achievement: Pull Sharkx2

Achievements

Achievement: Pull Sharkx2

Block or report diegonti

Block user

Prevent this user from interacting with your repositories and sending you notifications. Learn more about blocking users.

You must be logged in to block users.

Please don't include any personal information such as legal names or email addresses. Maximum 100 characters, markdown supported. This note will be visible to only you.
Report abuse

Contact GitHub support about this user’s behavior. Learn more about reporting abuse.

Report abuse
diegonti/README.md
  • 👋 Hi, I’m @diegonti
  • 💻 I’m interested in computational chemistry and data science
  • ⚛ I’m a Chemistry grad currently doing a PhD in Computational Chemistry at the University of Barcelona
  • 📫 You can reach me at [email protected]

Pinned Loading

  1. VASP-MXenes VASP-MXenes Public

    Python scripts used for the paper "Tuning MXenes towards their Use in Photocatalytic Water Splitting", published in EEM.

    Python 11 1

  2. mxgap mxgap Public

    MXgap is a Machine Learning tool for quickly predicting the bandgap of MXene compounds with little to no effort.

    Python 3

  3. EE EE Public

    Practical Sessions problems for the Electronic Structure course of the "Atomistic and Multiscale Computational Modelling" Master Degree. Course 2022-2023.

    Python 1

  4. ICC ICC Public

    Practical Sessions problems for the Introduction to Scientific Computing course of the "Atomistic and Multiscale Computational Modelling" Master Degree. Course 2022-2023.

    Jupyter Notebook

  5. MD_Simulation MD_Simulation Public

    EIA Project for the Computational Modelling Master's Degree.

    Fortran 2

  6. NeuralNetwork NeuralNetwork Public

    NeuralNetwork from scratch following TheCodingTrain videos

    Python