Skip to content
#

variational-monte-carlo

Here are 12 public repositories matching this topic...

DeepErwin is a python 3.8+ package that implements and optimizes JAX 2.x wave function models for numerical solutions to the multi-electron Schrödinger equation. DeepErwin supports weight-sharing when optimizing wave functions for multiple nuclear geometries and the usage of pre-trained neural network weights to accelerate optimization.

  • Updated Dec 19, 2024
  • Python

Improve this page

Add a description, image, and links to the variational-monte-carlo topic page so that developers can more easily learn about it.

Curate this topic

Add this topic to your repo

To associate your repository with the variational-monte-carlo topic, visit your repo's landing page and select "manage topics."

Learn more