ipie stands for Intelligent Python-based Imaginary-time Evolution with a focus on simplicity and speed.
☆69May 27, 2026Updated last month
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☆27Dec 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 last month
- ☆19Jul 25, 2022Updated 3 years ago
- ☆59Jun 27, 2026Updated last week
- Simple, predictable pricing with DigitalOcean hosting • AdAlways know what you'll pay with monthly caps and flat pricing. Enterprise-grade infrastructure trusted by 600k+ customers.
- 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☆101Jun 2, 2026Updated last month
- The Cornell-Holland Ab-initio Materials Package (CHAMP) is a quantum Monte Carlo suite of programs for electronic structure calculations …☆22Jun 15, 2026Updated 2 weeks ago
- Classical shadows codes for quantum simulations of fermions and qubits, with error-mitigation routines for systems with symmetries☆21Jun 14, 2024Updated 2 years ago
- Quantum Monte Carlo package, TurboRVB☆31Nov 25, 2025Updated 7 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☆23Updated this week
- A modern C++ library for high-performance configuration interaction methods☆21Apr 27, 2026Updated 2 months ago
- ☆15Feb 20, 2025Updated last year
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- A Python package for wave function-based quantum embedding☆41May 18, 2026Updated last month
- JAX accelerated Quantum Monte Carlo☆115Jun 26, 2026Updated last week
- Coupled-cluster package written in Python.☆50May 28, 2026Updated last month
- 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…☆393Updated this week
- A minimal block sparse symmetric and fermionic tensor python library☆34Updated this 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.☆71Aug 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…☆22Jun 26, 2026Updated last week
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- Tensorflow 1.x Quantum Simulator☆14Jun 17, 2022Updated 4 years ago
- ☆70Jun 15, 2025Updated last year
- Cornell-Holland Ab-initio Materials Package☆17Aug 10, 2024Updated last year
- ☆10Sep 27, 2024Updated last year
- ☆125Jun 9, 2025Updated last year
- 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 8 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☆40Apr 30, 2026Updated 2 months ago
- Serverless GPU API endpoints on Runpod - Get Bonus Credits • AdSkip the infrastructure headaches. Auto-scaling, pay-as-you-go, no-ops approach lets you focus on innovating your application.
- An example to implement PBC SCF☆14Jul 10, 2018Updated 7 years ago
- Supporting code for "Autoregressive neural-network wavefunctions for ab initio quantum chemistry".☆44Jun 17, 2022Updated 4 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 5 months ago
- Deep learning quantum Monte Carlo for electrons in real space☆418Jun 18, 2026Updated 2 weeks ago