Quantum Mechanics Python Packages

quacc

quacc is a flexible platform for computational materials science and quantum chemistry that is built for the big data era.

432K 257 70

qutip

QuTiP: Quantum Toolbox in Python

355K 2K 755

qiskit-connector

Qiskit connector is quantum computing SDK extension which is a helper for Qiskit runtime service that streamlines authentication, plan detection, and backend selection for quantum computing algorithms. using Qiskit connector intelligence Core.

163K 4 1

openjij

OpenJij : Framework for the Ising model and QUBO.

73K 125 34

cirq-superstaq

https://superstaq.readthedocs.io

14K 117 23

general-superstaq

https://superstaq.readthedocs.io

14K 117 23

qiskit-superstaq

https://superstaq.readthedocs.io

11K 117 23

torchani

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.

8K 543 137

supermarq

https://superstaq.readthedocs.io

7K 117 23

checks-superstaq

https://superstaq.readthedocs.io

7K 117 23

erwinjr2

A user friendly solver with GUI for 1D quantum problem and QCL simulation

6K 15 5

pyopencap

An open source program for the description of metastable electronic states in molecules.

6K 24 7

maxwellbloch

A Python package for solving the coupled Maxwell-Bloch equations describing the nonlinear propagation of near-resonant light through thermal quantised systems such as atomic vapours.

3K 35 13

chemlib

🧪 A comprehensive chemistry library for Python.

3K 66 15

pipeschrod

⚛️ PipeSchrod: An intuitive, pipeline-based Python library to define, solve, and visualize Schrödinger equation. Supports multiple potential models (Cornell, Harmonic) and solvers (Matrix, Numerov). Build quantum mechanics pipelines effortlessly using the >> operator! 🚀

2K 1 0