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48 search results found

Qutip ⭐ 1,525

QuTiP: Quantum Toolbox in Python

Qmsolve ⭐ 501

⚛️ A module for solving and visualizing the Schrödinger equation.

Torchani ⭐ 411

Accurate Neural Network Potential on PyTorch

Quantum Computing Collection Of Resources ⭐ 215

A Well Maintained Repository On Quantum Computing Resources [Code+Theory] Updated Regularly During My Time At IBM, Qubit x Qubit And The Coding School's Introduction To Quantum Computing Course '21

ChemML is a machine learning and informatics program suite for the chemical and materials sciences.

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

Slow Momentum Fast Reversion ⭐ 98

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).

OpenJij : Framework for the Ising model and QUBO.

Computer algebra package for quantum mechanics and photonic quantum networks

An implementation of the time dependent variational principle for matrix product states

Electronvisualized ⭐ 53

Public Archive: Beautiful and Elegant Quantum Mechanics Visualization.

This library tackles the construction and efficient execution of computational chemistry workflows

Python implementation of Krotov's method for quantum optimal control

Quanestimation ⭐ 38

QuanEstimation is an open-source toolkit for quantum parameter estimation.

Quantum_notebooks ⭐ 37

Jupyter Notebooks that demonstrate SymPy's symbolic quantum mechanics package.

A mirror of https://gitlab.kwant-project.org/qt/qsymm

An efficient Python-based framework for implementing qubit subspace methods, reducing the resource requirements for near-term quantum simulations.

Numqm_basic ⭐ 34

A mini-course offered to Undergrad physics students

Pythoncompphys ⭐ 31

Some python workbooks with various topics from Computational Physics

Atoms In Molecules Neural Network Potential

🧪 A comprehensive chemistry library for Python.

Miniqubit ⭐ 24

Quantum emulator of the IBM Quantum experience

A python script that solves the one dimensional time-independent Schrodinger equation for bound states. The script uses a Numerov method to solve the differential equation and displays the desired energy levels and a figure with an approximate wave function for each of these energy levels.

Schrodingerwellpython ⭐ 21

2D 3D Time independent FDM Schrodinger equation solver for arbitrary shape of well

Quantarhei ⭐ 20

Open Quantum System Theory for Molecular Systems

Python 2d Simulation Of Schrodinger Equation ⭐ 18

Une simulation de l'évolution d'un paquet d'onde gaussien

Ase Espresso ⭐ 17

ase interface for Quantum Espresso

Hydrogen Wavefunctions ⭐ 15

Hydrogen wavefunction modeling and electron probability density plots

Maxwellbloch ⭐ 15

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.

Quantum Refinement Module

A collection of tools designed for the automatic construction, and subsequent analysis, of chemical compounds.

Qspectra ⭐ 12

Quantum simulations of nonlinear spectroscopy and dynamics for molecular aggregates

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

A set of simple tutorial programs for quantum computing including a game, Fly Unicorn.

Non-linear Schrodinger Equation Solver

Library for numerically solving the Gross-Pitaevskii equations for scalar, two-component, spin-1, and spin-2 Bose-Einstein condensate systems.

Quantumoptics.jl Benchmarks ⭐ 9

Benchmarks for popular Quantum Optics frameworks

Quantum Computing ⭐ 8

Materials written by @zodiacfireworks and @RcrdPhysics as part ot the IBM Qiskit Global Summer School.

The Qis|krypt⟩ is a software suite of protocols of quantum cryptography and quantum communications, as well, other protocols and algorithms, built using IBM’s open-source Software Development Kit for quantum computing Qiskit. ⚛️ 🔐

Numerically exact Green's functions for lattice polaron models, easily and efficiently

Quantum Computing Python Library

Solve the Schrodinger equation for a variety of 1D and 2D potentials.

QM/DMD engine. Protein Hybrid Discrete Dynamics/DFT

Infinite Square Well Schrodinger Equation ⭐ 6

Analytical solution to the Time-Dependent Schrodinger equation for a particle in an infinite square well

Efficient and stable Determinant Quantum Monte Carlo simulations in Python

Sequencing ⭐ 5

Simulate realistic quantum control sequences using QuTiP

Qe Docset ⭐ 5

Dash docset generator for Quantum ESPRESSO.

Pytalises ⭐ 5

Easy to use Schrödinger equation solver

A library for analyzing potential energy surfaces (PESs) and using the resulting PES descriptors for constructing forcefield parameters.

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