public version of our general contraction code project
☆11Jan 26, 2026Updated 3 months ago
Alternatives and similar repositories for GeCCo-public
Users that are interested in GeCCo-public are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- SOC integrals generator with atomic mean field approximation☆10Apr 26, 2026Updated last week
- A very simple quantum chemistry program☆10Jan 4, 2019Updated 7 years ago
- Aquarius is a parallel quantum chemistry package built on the Cyclops Tensor Framework which provides high-performance structured tensor …☆28Mar 6, 2024Updated 2 years ago
- Automatic equation of motion coupled cluster generator☆17Jul 29, 2023Updated 2 years ago
- ☆14Apr 26, 2026Updated last week
- 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.
- PyMES is a package for developing new methods in quantum chemistry.☆14Apr 24, 2026Updated last week
- Quantum Package : a programming environment for wave function methods☆79Apr 22, 2026Updated 2 weeks ago
- A Wick theorem kernel written in C++ and interfaced with Python☆51Feb 1, 2025Updated last year
- QuAcK: a software for emerging quantum electronic structure methods☆32Updated this week
- Python implementation of electronic structure theories for simulating spectroscopic properties☆21Updated this week
- Fanpy is a free and open-source Python library for developing and testing multideterminant wavefunctions and related ab initio methods in…☆21Updated this week
- ☆14Feb 20, 2025Updated last year
- I can't believe it's NonAbelian!☆33Jan 5, 2026Updated 4 months ago
- ☆60Mar 2, 2026Updated 2 months ago
- 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.
- Arrow - Fast Semistochastic Heat Bath Configuration Interaction Solver (SHCI)☆36Oct 27, 2025Updated 6 months ago
- The EXP-T program package is designed for high-precision modeling of molecular electronic structure using the relativistic Fock space mul…☆20Jun 10, 2025Updated 10 months ago
- This is obsolete. Use this:☆21Aug 6, 2016Updated 9 years ago
- A modern C++ library for high-performance configuration interaction methods☆20Apr 27, 2026Updated last week
- Python quantum chemistry (experimental and test routines)☆13May 21, 2021Updated 4 years ago
- ☆11Mar 13, 2021Updated 5 years ago
- Amons-based quantum machine learning for quantum chemistry☆26Nov 4, 2025Updated 6 months ago
- Coupled-cluster package written in Python.☆50Nov 17, 2025Updated 5 months ago
- ☆11Apr 25, 2026Updated last week
- Virtual machines for every use case on DigitalOcean • AdGet dependable uptime with 99.99% SLA, simple security tools, and predictable monthly pricing with DigitalOcean's virtual machines, called Droplets.
- Automated workflow for generating quantum chemistry calculation of explicitly solvated molecules☆58Mar 12, 2026Updated last month
- A symbolic algebra system for tensorial and noncommutative algebras☆29Updated this week
- Open Source Exascale Quantum Chemistry Software☆32Apr 12, 2026Updated 3 weeks ago
- Jasspa's microemacs☆12Apr 20, 2023Updated 3 years ago
- Reference implementation of GW☆13Jul 22, 2019Updated 6 years ago
- Fermi quantum chemistry program☆165Jun 26, 2025Updated 10 months ago
- ☆12Apr 15, 2024Updated 2 years ago
- A Python script for rendering cube files generated by Psi4☆19Mar 30, 2025Updated last year
- ☆55Sep 12, 2024Updated last year
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Donostia Natural Orbital Functional Software☆24Apr 13, 2026Updated 3 weeks ago
- RPMD and rate constant calculations on black-box and machine-learning potential energy surfaces☆16Apr 16, 2026Updated 2 weeks ago
- PyCC is a simple, Python-based, reference implementation of the coupled cluster method of ab initio quantum chemistry.☆61Apr 7, 2026Updated 3 weeks ago
- Arbitrary-order derivatives of popular electronic structure methods, such as Hartree-Fock and coupled cluster theory.☆70Aug 21, 2024Updated last year
- A C++ library for evaluating non-orthogonal matrix elements in electronic structure☆28Feb 19, 2025Updated last year
- Implementation of sparse Pauli dynamics in Python☆14Oct 5, 2025Updated 7 months ago
- ☆25Nov 5, 2025Updated 6 months ago