HQSquantumsimulations / ActiveSpaceFinderLinks
☆31Updated last year
Alternatives and similar repositories for ActiveSpaceFinder
Users that are interested in ActiveSpaceFinder are comparing it to the libraries listed below
Sorting:
- ☆55Updated last year
- Generate 1- and 2-electron integrals so that molecular quantum chemistry software can be used for model Hamiltonians.☆52Updated last month
- Python library for real space quantum Monte Carlo☆98Updated 2 weeks ago
- Files for QMC Workshop 2021☆60Updated 4 years ago
- Python Based Auxiliary-Field Quantum Monte Carlo☆27Updated 2 years ago
- A Python package for wave function-based quantum embedding☆37Updated last month
- pyblock3: an efficient python block-sparse tensor library☆28Updated 5 months ago
- Quantum dynamics package based on tensor network states☆66Updated 3 weeks ago
- ☆65Updated 7 months ago
- ☆34Updated 3 months ago
- CheMPS2: a spin-adapted implementation of DMRG for ab initio quantum chemistry☆73Updated 6 months ago
- ipie stands for Intelligent Python-based Imaginary-time Evolution with a focus on simplicity and speed.☆61Updated 3 months ago
- Quantum Package : a programming environment for wave function methods☆77Updated this week
- Ab initio full cell dynamical mean-field theory (DMFT) and GW+DMFT for solids☆39Updated 2 years ago
- A library of density matrix embedding theory (DMET).☆38Updated 11 months ago
- Python module for quantum chemistry☆76Updated this week
- Reference implementation of GW☆13Updated 6 years ago
- Arrow - Fast Semistochastic Heat Bath Configuration Interaction Solver (SHCI)☆34Updated 2 months ago
- Open source stochastic quantum chemistry☆79Updated last month
- Efficient parallel quantum chemistry DMRG in MPO formalism☆96Updated last week
- Mathematica modules for electronic structure calculations☆36Updated 2 years ago
- An MPO-based DMRG code for Quantum Chemistry☆13Updated 7 years ago
- solid_dmft is a versatile python wrapper to perform DFT+DMFT calculations utilizing the TRIQS software library.☆39Updated last month
- A fully autodifferentiable and variational HF☆43Updated 5 years ago
- Coupled-cluster package written in Python.☆46Updated 2 months ago
- QC-DMET: a python implementation of density matrix embedding theory for ab initio quantum chemistry☆46Updated 5 years ago
- The mainline development distribution for QWalk☆35Updated 6 years ago
- do a simple closed shell Hartree-Fock using McMurchie-Davidson to compute integrals☆85Updated last year
- adcc: Seamlessly connect your program to ADC☆38Updated last week
- Repository for PseudopotentialLibrary.org website and database☆15Updated 4 months ago