psi4numpy
by psi4
Combining Psi4 and Numpy for education and development.
AI summary
Quantum chemistry toolkit
An interactive quantum chemistry framework combining Psi4 and Numpy for education and development
- stars
- 351
- forks
- 160
- watching
- 36
- awesome list
- 1
Similar projects
Found by comparing what the projects do, not just their names.
Quantum Chemistry Engine
Software package for simulating molecular properties through ab initio quantum chemistry methods
Quantum toolkit
A Python library providing numerical tools for studying quantum information objects
Cheminformatics tutorial
A comprehensive guide to chemoinformatics using Python and RDKit
qutip/qutip1.7K
Quantum simulator
A software framework for simulating the dynamics of quantum systems
Quantum chemistries
A Python module for performing quantum chemical simulations of chemistry.
Quantum toolkit
Mathematica package with functions for quantum information processing and theoretical computations
Quantum info calc lib
A Python library for performing 'quantum information many-body' calculations using tensor networks.
Simulation framework
Enabling researchers to develop and run quantum chemistry simulations on various backends
Quantum compiler library
An experimental JIT compiler for hybrid quantum-classical programs
rigetti/pyquil1.4K
Quantum programmer
A Python library for programming quantum computers using the Quil instruction language.
Integration library
Provides a comprehensive set of numerical integration schemes for various domains and dimensionality
epam/indigo318
Chemistry toolkit
A comprehensive toolkit for chemistry and molecule analysis, including search engines, visualization tools, and data manipulation utilities.
Quantum neural network toolkit
A toolkit for building quantum neural networks on near-term quantum computers.
Quantum library
This library provides tools and classes to interface with Qiskit for machine learning and quantum programming using Riemannian geometry.
Chemistry Analysis Toolkit
A Python-based toolkit for automating computational chemistry tasks and data analysis from quantum chemistry software output files
Featured in 1 awesome list
Each link jumps to the spot where the list mentions psi4numpy.
