☆19Jul 25, 2022Updated 3 years ago
Alternatives and similar repositories for VMC
Users that are interested in VMC are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Arrow - Fast Semistochastic Heat Bath Configuration Interaction Solver (SHCI)☆36Oct 27, 2025Updated 6 months ago
- Cornell-Holland Ab-initio Materials Package☆17Aug 10, 2024Updated last year
- ☆11Mar 13, 2021Updated 5 years ago
- DMRG and DMRGSCF☆15Mar 8, 2024Updated 2 years ago
- A library of density matrix embedding theory (DMET).☆41Jan 26, 2025Updated last year
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Library for local orbital scaling correction (LOSC).☆19Jul 4, 2024Updated last year
- Dyson equation solvers for Green's function methods☆12May 11, 2026Updated last week
- ☆66Jun 15, 2025Updated 11 months ago
- Tensor Framework for Cyclic Symmetry☆18Aug 30, 2022Updated 3 years ago
- Main repository for the CP-PAW code☆12Apr 29, 2026Updated 3 weeks ago
- Symbolic manipulation of operator strings for quantum chemistry☆22Jan 10, 2023Updated 3 years ago
- The Ghent Quantum Chemistry Package for electronic structure calculations☆37Dec 12, 2025Updated 5 months ago
- Standalone NECI codebase designed for FCIQMC and other stochastic quantum chemistry methods.☆57Updated this week
- Density matrix embedding theory for periodic systems☆18Dec 3, 2021Updated 4 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.
- OpenRSP: open-ended response theory.☆16Aug 16, 2020Updated 5 years ago
- A C++ library for evaluating non-orthogonal matrix elements in electronic structure☆28Feb 19, 2025Updated last year
- SeQuant: second quantization toolkit☆16Nov 19, 2022Updated 3 years ago
- Correlation consistent Gaussian basis sets for solids☆25May 31, 2025Updated 11 months ago
- python module for performing blocking analysis on data containing serial correlations☆45Mar 20, 2024Updated 2 years ago
- ☆23Mar 11, 2023Updated 3 years ago
- Basis set optimization library for quantum chemistry☆36Jun 27, 2025Updated 10 months ago
- MPI parallelization for PySCF☆35Nov 1, 2024Updated last year
- ipie stands for Intelligent Python-based Imaginary-time Evolution with a focus on simplicity and speed.☆69Mar 7, 2026Updated 2 months ago
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- n2v: Density-to-potential Inversion Suite☆24Aug 29, 2022Updated 3 years ago
- Autoregressive model for solving statistical mechanics problems☆11Mar 19, 2021Updated 5 years ago
- Julia implementation of various electron-correlation methods (main focus on coupled cluster methods).☆25Apr 23, 2026Updated last month
- Python Based Auxiliary-Field Quantum Monte Carlo☆26Dec 11, 2023Updated 2 years ago
- Natural-orbital Functional based on PySCF☆11Aug 27, 2024Updated last year
- Ab initio full cell dynamical mean-field theory (DMFT) and GW+DMFT for solids☆39Apr 30, 2026Updated 3 weeks ago
- Projectively-optimized geminal and "fancyCI" wavefunctions☆17Aug 18, 2022Updated 3 years ago
- ☆15Apr 26, 2026Updated 3 weeks ago
- Python implementation of electronic structure theories for simulating spectroscopic properties☆22Updated this week
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- C++17 Wrapper for ScaLAPACK☆11Oct 5, 2023Updated 2 years ago
- gammcor code☆11Mar 10, 2026Updated 2 months ago
- Python library for real space quantum Monte Carlo☆100Apr 30, 2026Updated 3 weeks ago
- Donostia Natural Orbital Functional Software☆25Updated this week
- Spin-projected Unrestricted Hartree-Fock program☆10Apr 4, 2026Updated last month
- Coupled-cluster package written in Python.☆50Nov 17, 2025Updated 6 months ago
- A Python script for rendering cube files generated by Psi4☆19Mar 30, 2025Updated last year