ipie stands for Intelligent Python-based Imaginary-time Evolution with a focus on simplicity and speed.
☆69Mar 7, 2026Updated 2 months ago
Alternatives and similar repositories for ipie
Users that are interested in ipie are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Python Based Auxiliary-Field Quantum Monte Carlo☆26Dec 11, 2023Updated 2 years ago
- ☆10Oct 30, 2023Updated 2 years ago
- PyMES is a package for developing new methods in quantum chemistry.☆14May 8, 2026Updated 2 weeks ago
- ☆19Jul 25, 2022Updated 3 years ago
- ☆58May 12, 2026Updated last week
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- python module for performing blocking analysis on data containing serial correlations☆45Mar 20, 2024Updated 2 years ago
- Python library for real space quantum Monte Carlo☆100Apr 30, 2026Updated 3 weeks ago
- The Cornell-Holland Ab-initio Materials Package (CHAMP) is a quantum Monte Carlo suite of programs for electronic structure calculations …☆21May 17, 2026Updated last week
- Classical shadows codes for quantum simulations of fermions and qubits, with error-mitigation routines for systems with symmetries☆21Jun 14, 2024Updated last year
- Quantum Monte Carlo package, TurboRVB☆31Nov 25, 2025Updated 6 months ago
- Arbitrary order exchange-correlation functional derivatives using JAX.☆22Jul 12, 2020Updated 5 years ago
- Python implementation of electronic structure theories for simulating spectroscopic properties☆22Updated this week
- A modern C++ library for high-performance configuration interaction methods☆21Apr 27, 2026Updated 3 weeks ago
- ☆14Feb 20, 2025Updated last year
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- JAX accelerated Quantum Monte Carlo☆112May 12, 2026Updated last week
- A Python package for wave function-based quantum embedding☆40Apr 7, 2026Updated last month
- Coupled-cluster package written in Python.☆50Nov 17, 2025Updated 6 months ago
- A modular electronic structure theory code☆21Aug 11, 2018Updated 7 years ago
- Main repository for QMCPACK, an open-source production level many-body ab initio Quantum Monte Carlo code for computing the electronic st…☆386Updated this week
- A minimal block sparse symmetric and fermionic tensor python library☆34May 15, 2026Updated last week
- Exact diagonalization of Fermi-Hubbard and spin models on a lattice☆11Apr 17, 2024Updated 2 years ago
- Arbitrary-order derivatives of popular electronic structure methods, such as Hartree-Fock and coupled cluster theory.☆70Aug 21, 2024Updated last year
- Fanpy is a free and open-source Python library for developing and testing multideterminant wavefunctions and related ab initio methods in…☆21May 16, 2026Updated last week
- GPUs on demand by Runpod - Special Offer Available • AdRun AI, ML, and HPC workloads on powerful cloud GPUs—without limits or wasted spend. Deploy GPUs in under a minute and pay by the second.
- Tensorflow 1.x Quantum Simulator☆14Jun 17, 2022Updated 3 years ago
- ☆66Jun 15, 2025Updated 11 months ago
- Cornell-Holland Ab-initio Materials Package☆17Aug 10, 2024Updated last year
- ☆10Sep 27, 2024Updated last year
- ☆122Jun 9, 2025Updated 11 months ago
- CCT3: A PSI4 plugin which performs active-space coupled-cluster CCSDt calculations and which can determine non-iterative corrections to C…☆13Oct 25, 2023Updated 2 years ago
- Arrow - Fast Semistochastic Heat Bath Configuration Interaction Solver (SHCI)☆36Oct 27, 2025Updated 6 months ago
- Automatic equation of motion coupled cluster generator☆17Jul 29, 2023Updated 2 years ago
- Ab initio full cell dynamical mean-field theory (DMFT) and GW+DMFT for solids☆39Apr 30, 2026Updated 3 weeks ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- An example to implement PBC SCF☆14Jul 10, 2018Updated 7 years ago
- Supporting code for "Autoregressive neural-network wavefunctions for ab initio quantum chemistry".☆43Jun 17, 2022Updated 3 years ago
- A Julia code for performing variational Monte Carlo (VMC) simulations of determinantal wave functions☆15Nov 16, 2017Updated 8 years ago
- Pseudopotential converter from upf to psp8☆11Jan 25, 2023Updated 3 years ago
- A Wick theorem kernel written in C++ and interfaced with Python☆52Feb 1, 2025Updated last year
- decodense: Bond- and atom-wise decompositions of HF and KS-DFT calculations☆12Jan 29, 2026Updated 3 months ago
- Deep learning quantum Monte Carlo for electrons in real space☆413May 4, 2026Updated 3 weeks ago