QMC=Chem version 2
☆20Dec 30, 2025Updated 8 months ago
Alternatives and similar repositories for qmcchem2
Users that are interested in qmcchem2 are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- AiiDA plugin for Quantum Package 2.0☆13May 29, 2024Updated 2 years ago
- Set of tools for trexio files☆20Jul 1, 2026Updated last month
- Quantum Monte Carlo Kernel Library☆41Jul 8, 2026Updated last month
- TREX I/O library☆73Aug 24, 2026Updated last week
- Automatic equation of motion coupled cluster generator☆17Jul 29, 2023Updated 3 years ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- QuAcK: a software for emerging quantum electronic structure methods☆34Updated this week
- The Cornell-Holland Ab-initio Materials Package (CHAMP) is a quantum Monte Carlo suite of programs for electronic structure calculations …☆22Aug 7, 2026Updated 3 weeks ago
- gammcor code☆11Mar 10, 2026Updated 5 months ago
- Repository for PseudopotentialLibrary.org website and database☆17Jun 29, 2026Updated 2 months ago
- Cornell-Holland Ab-initio Materials Package☆17Aug 10, 2024Updated 2 years ago
- Dyson equation solvers for Green's function methods☆12Jul 6, 2026Updated last month
- Quantum Package : a programming environment for wave function methods☆79Updated this week
- An open-source library for reduced-density matrix-based analysis and computation☆20Apr 2, 2023Updated 3 years ago
- ☆15Aug 3, 2026Updated 3 weeks ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- A python application to help you place your processes and threads on the cpu cores, and to let you check the placement is correct☆16Apr 4, 2025Updated last year
- Donostia Natural Orbital Functional Software☆27May 18, 2026Updated 3 months ago
- Open Orbital Optimizer☆38Updated this week
- A Python package for wave function-based quantum embedding☆49Updated this week
- Mathematica modules for electronic structure calculations☆36Aug 30, 2023Updated 3 years ago
- C++ and Python library for Polarizable Embedding☆24Apr 27, 2026Updated 4 months ago
- Implementation of a Smoothed Particle Hydrodynamics (SPH) fluid simulation using Three.js☆11May 24, 2026Updated 3 months ago
- Numerical integration grid for molecules.☆51Aug 17, 2026Updated last week
- A C++ library for evaluating non-orthogonal matrix elements in electronic structure☆28Feb 19, 2025Updated last year
- 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.
- A Reusable Library for Second-Order Trust Region Orbital Optimization☆22May 26, 2026Updated 3 months ago
- Python implementation of electronic structure theories for simulating spectroscopic properties☆25Updated this week
- Python tools for automating routine tasks encountered when running quantum chemistry computations.☆62Jun 10, 2026Updated 2 months ago
- Accurate many-body perturbation theory calculations of the electronic structure of molecules and clusters☆46May 29, 2026Updated 3 months ago
- Package to handle integrals over Gaussian-type atomic orbitals.☆33Updated this week
- Symbolic manipulation of operator strings for quantum chemistry☆23Jan 10, 2023Updated 3 years ago
- QuantNBody : a python package for quantum chemistry/physics to manipulate many-body operators and wave functions.☆15Mar 10, 2026Updated 5 months ago
- Set of quantum chemistry programs and libraries☆44Dec 19, 2020Updated 5 years ago
- A generic implementation of tensor einsum in Fortran.☆30Jan 29, 2021Updated 5 years ago
- Deploy open-source AI quickly and easily - Special Bonus Offer • AdRunpod Hub is built for open source. One-click deployment and autoscaling endpoints without provisioning your own infrastructure.
- Collection of codes used for quantum chemistry calculations, including Hartree-Fock, Coupled Cluster (CCSD), EOMCC, and other various thi…☆19May 17, 2021Updated 5 years ago
- ☆15Feb 20, 2025Updated last year
- PyMES is a package for developing new methods in quantum chemistry.☆14May 8, 2026Updated 3 months ago
- Multi-collinear functional☆10Feb 12, 2026Updated 6 months ago
- general GTO integrals for quantum chemistry☆250Jun 21, 2026Updated 2 months ago
- Quantum Monte Carlo package, TurboRVB☆31Nov 25, 2025Updated 9 months ago
- Python Tools for the POP Metrics☆13Feb 16, 2022Updated 4 years ago