qutip/QuantumToolbox.jl

Quantum Toolbox in Julia

Language: Julia - Size: 64.2 MB - Last synced at: 5 days ago - Pushed at: 5 days ago - Stars: 86 - Forks: 20

lgcrego/Dynemol

DynEMol: tools for studying Dynamics of Electrons in Molecules

Language: Fortran - Size: 16.3 MB - Last synced at: 10 days ago - Pushed at: 10 days ago - Stars: 9 - Forks: 6

tjira/acorn

Fast and simple way to electronic structure methods.

Language: Zig - Size: 45.9 MB - Last synced at: 10 days ago - Pushed at: 10 days ago - Stars: 1 - Forks: 0

netket/netket_fidelity

Projected time-dependent Variational Monte Carlo (p-tVMC) method based on infidelity optimization for variational simulation of quantum dynamics.

Language: Python - Size: 149 KB - Last synced at: 13 days ago - Pushed at: 6 months ago - Stars: 13 - Forks: 6

adam-srut/QD-engine

Quantum dynamics engine for one- and two-dimensional systems

Language: Julia - Size: 348 KB - Last synced at: 15 days ago - Pushed at: 15 days ago - Stars: 0 - Forks: 0

tencent-quantum-lab/tensorcircuit

Tensor network based quantum software framework for the NISQ era

Language: Python - Size: 13.4 MB - Last synced at: 12 days ago - Pushed at: 10 months ago - Stars: 303 - Forks: 81

tensorcircuit/tensorcircuit-ng

Tensor network based quantum software framework: next generation

Language: Python - Size: 15.3 MB - Last synced at: 11 days ago - Pushed at: about 2 months ago - Stars: 18 - Forks: 4

qutip/HierarchicalEOM.jl

An efficient Julia framework for Hierarchical Equations of Motion (HEOM) in open quantum systems

Language: Julia - Size: 18.3 MB - Last synced at: 11 days ago - Pushed at: 11 days ago - Stars: 42 - Forks: 10

shuaigroup/Renormalizer

Quantum dynamics package based on tensor network states

Language: Python - Size: 34 MB - Last synced at: 24 days ago - Pushed at: 24 days ago - Stars: 59 - Forks: 18

lagrenge94/Hopf-algebras-and-solvable-unitary-circuits

Mathematica codes for Hopf algebras and solvable unitary circuits accompanying the paper arXiv:2409.17215, published in Phys. Rev. B 111, 104315 (2025). All equations in the file FibonacciQCA.nb refer to equations in this paper.

Language: Mathematica - Size: 2.04 MB - Last synced at: 25 days ago - Pushed at: 25 days ago - Stars: 2 - Forks: 0

IgorBrandao42/Quantum-Gaussian-Information-Toolbox

QuGIT is a numerical toolbox in Python for simulation of gaussian quantum states and their time evolution through unconditional and conditional dynamics

Language: Python - Size: 758 KB - Last synced at: 11 days ago - Pushed at: almost 3 years ago - Stars: 25 - Forks: 8

torchmd/mdgrad

Pytorch differentiable molecular dynamics

Language: Python - Size: 215 MB - Last synced at: 3 months ago - Pushed at: over 2 years ago - Stars: 172 - Forks: 17

jwa7/quantum_HEOM

A tool to model the bath relaxation dynamics of open quantum systems by Lindblad and Hierarchical Equations of Motion (HEOM) approaches.

Language: Python - Size: 10.8 MB - Last synced at: 12 days ago - Pushed at: over 2 years ago - Stars: 21 - Forks: 10

PGelss/wave_train

A Python package for numerical quantum mechanics of chain-like systems based on tensor trains

Language: Python - Size: 3.34 MB - Last synced at: 14 days ago - Pushed at: 8 months ago - Stars: 7 - Forks: 3

Arif-PhyChem/MLQD

MLQD is a Python Package for Machine Learning-based Quantum Dissipative Dynamics

Language: Jupyter Notebook - Size: 34.2 MB - Last synced at: 1 day ago - Pushed at: 8 months ago - Stars: 14 - Forks: 4

dceresoli/ce-tddft

Real-time TDDFT for Quantum-Espresso

Language: Fortran - Size: 3.71 MB - Last synced at: 5 months ago - Pushed at: almost 2 years ago - Stars: 23 - Forks: 13

MolQuantDynLab-Haverford/MolQuantDynLab-Haverford.github.io

Website of the (Molecular) Quantum Dynamics Lab at Haverford College

Language: Python - Size: 31.3 MB - Last synced at: 8 months ago - Pushed at: 8 months ago - Stars: 0 - Forks: 0

MesoscienceLab/mesohops

This is a package developed in the Mesoscience Lab to perform Hierarchy of Pure State (HOPS) calculations using an adaptive basis that provides size-invariant scaling for large systems.

Language: Python - Size: 3.91 MB - Last synced at: 9 months ago - Pushed at: 9 months ago - Stars: 14 - Forks: 5

Arif-PhyChem/OSTL

Code and data for our paper in JPCL "One-Shot Trajectory Learning of Open Quantum Systems Dynamics" https://doi.org/10.1021/acs.jpclett.2c01242

Language: Python - Size: 10.7 KB - Last synced at: 10 months ago - Pushed at: 10 months ago - Stars: 2 - Forks: 1

Arif-PhyChem/AIQD_FMO

Script for data generation and Code for our article "Predicting the future of excitation energy transfer in light-harvesting complex with artificial intelligence-based quantum dynamics"

Language: Python - Size: 131 KB - Last synced at: 10 months ago - Pushed at: 10 months ago - Stars: 3 - Forks: 2

lauvergn/Tnum-Tana

Generate Kinetic Energy Operators (KEO) with curvilinear coordinates (z-matrix, polyspherical ...)

Language: Fortran - Size: 32.2 MB - Last synced at: about 1 year ago - Pushed at: about 1 year ago - Stars: 0 - Forks: 0

lauvergn/QuantumModelLib

This module enables to use potentials extracted from the literature. It has the following features: * One or several degrees of freedom * One or several electronic states * For each electronic state, the energy, gradient and hessian can be obtained in the diabatic or adiabatic representations

Language: Fortran - Size: 4.28 MB - Last synced at: about 1 year ago - Pushed at: about 1 year ago - Stars: 4 - Forks: 1

binggu56/qmd

Science tools for quantum mechanics implemented mainly with PYTHON.

Language: Fortran - Size: 175 MB - Last synced at: about 1 year ago - Pushed at: over 6 years ago - Stars: 0 - Forks: 1

Sumner-Group/SD-QHD

C++ code to compute electron trajectories in molecular orbitals using spin-dependent quantum hydrodynamics

Language: C++ - Size: 838 KB - Last synced at: over 1 year ago - Pushed at: over 1 year ago - Stars: 3 - Forks: 0

andywiecko/SOLIDstate

SOLID implementation of standard solid states physics

Language: C++ - Size: 50.5 MB - Last synced at: over 1 year ago - Pushed at: over 5 years ago - Stars: 5 - Forks: 2

diegonti/DQ

Practical session for the Quantum Dynamics course of the "Atomistic and Multiscale Computational Modelling" Master Degree. Course 2022-2023.

Language: Python - Size: 170 MB - Last synced at: about 2 months ago - Pushed at: almost 2 years ago - Stars: 0 - Forks: 0

ryuikaneko/lindblad_gutzwiller

Language: Python - Size: 26.4 KB - Last synced at: almost 2 years ago - Pushed at: over 3 years ago - Stars: 2 - Forks: 2

HPQC-LABS/FeynDyn

Type an M x M matrix for your open quantum system Hamiltonian, and give a spectral density (analytic or numerical). FeynDyn gives the density matrix dynamics according to the Leggett-Caldeira bath or the Feynman-Vernon bath at any temperature. Can do up to 16 qubits (65536 levels) and infinitely many bath modes. Email [email protected] for the latest version or any questions.

Language: MATLAB - Size: 43 MB - Last synced at: about 2 years ago - Pushed at: over 2 years ago - Stars: 20 - Forks: 11

lauvergn/ElVibRot-TnumTana

General quantum dynamics code using curvilinear coordinates and a numerical kinetic energy operator (with Tnum) : (i) Vibrational levels, intensities for floppy molecular system (ii) Wave-packet propagation with or witout time dependant Hamiltonian (iii) Quantum gate and optimal control.

Language: Fortran - Size: 100 MB - Last synced at: over 1 year ago - Pushed at: over 1 year ago - Stars: 10 - Forks: 2

Arif-PhyChem/Quantum_dissipative_dynamics_with_kernel_methods

Speeding up quantum dissipative dynamics of open systems with kernel methods

Language: Shell - Size: 55.7 MB - Last synced at: about 2 years ago - Pushed at: about 3 years ago - Stars: 0 - Forks: 0

tcompa/GutzwillerDynamics

Gutzwiller state for the Bose-Hubbard model, with complex and site-dependent coefficients

Language: Python - Size: 157 KB - Last synced at: almost 2 years ago - Pushed at: over 4 years ago - Stars: 3 - Forks: 2

fuentesigma/cyclotronReconstruction

Dynamical reconstruction of the classical motion of a charged particle moving in some external field

Language: Jupyter Notebook - Size: 1.61 MB - Last synced at: almost 2 years ago - Pushed at: over 2 years ago - Stars: 1 - Forks: 0

ryuikaneko/lindblad_free_fermion

Language: Python - Size: 16.9 MB - Last synced at: almost 2 years ago - Pushed at: over 3 years ago - Stars: 1 - Forks: 1

ryuikaneko/quspin_example

Language: Python - Size: 3.62 MB - Last synced at: almost 2 years ago - Pushed at: over 4 years ago - Stars: 0 - Forks: 1

ryuikaneko/exact_diagonalization_dynamics

Language: Roff - Size: 4.13 MB - Last synced at: almost 2 years ago - Pushed at: almost 5 years ago - Stars: 1 - Forks: 2

yanzewu/pyqd

Quantum dynamics

Language: Python - Size: 80.1 KB - Last synced at: almost 2 years ago - Pushed at: almost 6 years ago - Stars: 0 - Forks: 0

tnorthey/using-vcham

How to use VCHam - a program to calculate the vibronic coupling Hamiltonian.

Size: 3.91 KB - Last synced at: 20 days ago - Pushed at: about 7 years ago - Stars: 0 - Forks: 1