Alternatives and similar repositories for VQE

Users that are interested in VQE are comparing it to the libraries listed below

• evangelistalab / qforte
  ☆55Updated last year
• JoonhoLee-Group / ipie
  ipie stands for Intelligent Python-based Imaginary-time Evolution with a focus on simplicity and speed.
  ☆61Updated 2 months ago
• QMCPACK / qmc_workshop_2021
  Files for QMC Workshop 2021
  ☆60Updated 4 years ago
• theochem / ModelHamiltonian
  Generate 1- and 2-electron integrals so that molecular quantum chemistry software can be used for model Hamiltonians.
  ☆35Updated last month
• tehruhn / bofin
  BoFiN HEOM Python version.
  ☆17Updated 2 years ago
• joselado / Advanced_Quantum_Materials_2025
  Teaching material for the course Advanced Quantum Materials at Aalto University
  ☆72Updated 6 months ago
• joselado / jyvaskyla_summer_school_2022
  Exercises for the Jyväskylä summer school 2022
  ☆29Updated 3 years ago
• pauxy-qmc / pauxy
  Python Based Auxiliary-Field Quantum Monte Carlo
  ☆27Updated 2 years ago
• block-hczhai / pyblock3-preview
  pyblock3: an efficient python block-sparse tensor library
  ☆28Updated 5 months ago
• WagnerGroup / pyqmc
  Python library for real space quantum Monte Carlo
  ☆98Updated last week
• joselado / SolidStatePhysics2024
  Interactive exercises for Solid State Physics course at Aalto University (2024)
  ☆37Updated 9 months ago
• jjgoings / pyqchem
  Python quantum chemistry (experimental and test routines)
  ☆12Updated 4 years ago
• ZhuGroup-Yale / fcdmft
  Ab initio full cell dynamical mean-field theory (DMFT) and GW+DMFT for solids
  ☆39Updated 2 years ago
• BoothGroup / Vayesta
  A Python package for wave function-based quantum embedding
  ☆37Updated last month
• fevangelista / wicked
  A Wick theorem kernel written in C++ and interfaced with Python
  ☆46Updated 11 months ago
• jjgoings / davidson
  davidson iterative diagonalizer
  ☆12Updated 4 years ago
• SebWouters / QC-DMET
  QC-DMET: a python implementation of density matrix embedding theory for ab initio quantum chemistry
  ☆46Updated 5 years ago
• jwa7 / quantum_HEOM
  A tool to model the bath relaxation dynamics of open quantum systems by Lindblad and Hierarchical Equations of Motion (HEOM) approaches.
  ☆21Updated 3 years ago
• nickirk / pymes
  PyMES is a package for developing new methods in quantum chemistry.
  ☆13Updated 2 weeks ago
• gkclab / libdmet_preview
  A library of density matrix embedding theory (DMET).
  ☆37Updated 11 months ago
• dceresoli / ce-tddft
  Real-time TDDFT for Quantum-Espresso
  ☆24Updated 2 years ago
• skmin-lab / unixmd
  ☆23Updated 2 weeks ago
• TRIQS / solid_dmft
  solid_dmft is a versatile python wrapper to perform DFT+DMFT calculations utilizing the TRIQS software library.
  ☆39Updated 3 weeks ago
• berkelbach-group / pyrho
  a python package for reduced density matrix techniques
  ☆16Updated 5 years ago
• aspuru-guzik-group / DiffiQult
  A fully autodifferentiable and variational HF
  ☆42Updated 5 years ago
• edeprince3 / pdaggerq
  ☆53Updated 3 weeks ago
• hczhai / fci-siso
  State Interaction Spin-Orbit (SISO) Method for CASSCF and FCI
  ☆13Updated 2 months ago
• awhite862 / wick
  Symbolic manipulation of operator strings for quantum chemistry
  ☆21Updated 3 years ago
• sokolov-group / prism
  Python implementation of electronic structure theories for simulating spectroscopic properties
  ☆18Updated this week
• materialscloud-org / hubbard-koopmans-2022
  Advanced Quantum ESPRESSO tutorial: Hubbard and Koopmans functionals from linear response
  ☆23Updated 3 years ago