TD-DMRG and VHCI package
☆11Jul 24, 2025Updated 9 months ago
Alternatives and similar repositories for Kylin-V
Users that are interested in Kylin-V are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- A python script to obtain XYG3-type doubly hybrid (xDH) results using the standard Gaussian xx package (xx=03, 09 and/or 16)☆15Sep 21, 2022Updated 3 years ago
- State Interaction Spin-Orbit (SISO) Method for CASSCF and FCI☆14Oct 29, 2025Updated 6 months ago
- Automatic MR based on PySCF☆17Jan 25, 2026Updated 3 months ago
- Efficient and stable Determinant Quantum Monte Carlo simulations in Python☆11Feb 23, 2026Updated 2 months ago
- DFT-D3 interface☆12Apr 3, 2023Updated 3 years ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- ☆46Oct 5, 2024Updated last year
- Quantum dynamics package based on tensor network states☆70Dec 20, 2025Updated 4 months ago
- Spin-projected Unrestricted Hartree-Fock program☆10Apr 4, 2026Updated last month
- ☆30Jul 15, 2025Updated 9 months ago
- ☆18Mar 30, 2026Updated last month
- 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
- Natural-orbital Functional based on PySCF☆11Aug 27, 2024Updated last year
- Main repository for the CP-PAW code☆12Apr 29, 2026Updated last week
- 《现代量子化学》汉化版☆179Updated this week
- 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.
- DMRG and DMRGSCF☆15Mar 8, 2024Updated 2 years ago
- ☆10Sep 27, 2024Updated last year
- ☆54Updated this week
- ☆38Sep 26, 2025Updated 7 months ago
- Geometrical Counter-Poise Correction☆14Nov 19, 2024Updated last year
- SOC integrals generator with atomic mean field approximation☆10Apr 26, 2026Updated 2 weeks ago
- LibRPA is a library offering access to physical properties computed using many-body perturbation theory.☆16Apr 24, 2026Updated 2 weeks ago
- An interface for ELK-Wannier90 calculations☆16Oct 13, 2020Updated 5 years ago
- In-Class/Active-Learning Exercises for Quantum Chemistry☆17Aug 13, 2018Updated 7 years ago
- 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.
- Solutions for Modern Quantum Chemistry, Szabo & Ostlund☆102Feb 16, 2025Updated last year
- This is a package developed in the Mesoscience Lab to perform Hierarchy of Pure State (HOPS) calculations using an adaptive basis that pr…☆17Apr 30, 2026Updated last week
- JAX/Flax implimentation of 'Attention Is All You Need' by Vaswani et al. (https://arxiv.org/abs/1706.03762)☆15Aug 16, 2021Updated 4 years ago
- Reference implementation of GW☆13Jul 22, 2019Updated 6 years ago
- Density matrix embedding theory for periodic systems☆18Dec 3, 2021Updated 4 years ago
- Run Jupyter lab as a desktop app☆12Feb 27, 2018Updated 8 years ago
- ⌨《Fortran语言实战》是一份由Fortran爱好者（Fortran-Fans）社区驱动的Fortran语言编程实战教程。☆47Dec 29, 2023Updated 2 years ago
- Donostia Natural Orbital Functional Software☆24Apr 13, 2026Updated 3 weeks ago
- 浙江大学王林军课题组入门指南☆85Mar 2, 2020Updated 6 years 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.
- Python module for quantum chemistry☆77Apr 21, 2026Updated 2 weeks ago
- An implementation of "Supervised Learning with Quantum-Inspired Tensor Networks" using TensorFlow☆11May 13, 2018Updated 7 years ago
- std2 program for computing excited states and response functions via simplified TD-DFT methods (sTDA, sTD-DFT, SF-sTD-DFT, XsTDA, XsTD-DF…☆51Oct 15, 2025Updated 6 months ago
- A library of density matrix embedding theory (DMET).☆41Jan 26, 2025Updated last year
- An MPO-based DMRG code for Quantum Chemistry☆13Jul 11, 2018Updated 7 years ago
- ☆19Jul 25, 2022Updated 3 years ago
- ☆40Feb 4, 2026Updated 3 months ago