#Quantum-mechanics
Showing 15 of 15 repositories tagged #quantum-mechanics, ranked by stars
⚛️ A module for solving and visualizing the Schrödinger equation.
TorchANI 2.0 is an open-source library that supports training, development, and research of ANI-style neural network interatomic potentials. It was originally developed and is currently maintained by the Roitberg group.
This code accompanies the the paper Slow Momentum with Fast Reversion: A Trading Strategy Using Deep Learning and Changepoint Detection (https://arxiv.org/pdf/2105.13727.pdf).
quacc is a flexible platform for computational materials science and quantum chemistry that is built for the big data era.
ChemML is a machine learning and informatics program suite for the chemical and materials sciences.
p4vasp, the VASP Visualization Tool
AI-enhanced computational chemistry
A collection of interactive notebooks to explain concepts of quantum mechanics and related topics
Atoms In Molecules Neural Network Potential
Public Archive: Beautiful and Elegant Quantum Mechanics Visualization.
Some python workbooks with various topics from Computational Physics
🧪 A comprehensive chemistry library for Python.
This library tackles the construction and efficient execution of computational chemistry workflows
A package to simplify working with symmetry-adapted quantum many-body bases. Provides a good foundation for writing custom exact diagonalization and variational Monte Carlo software
The Swiss Army Knife of Applied Quantum Technology (Experimental Tech)