SALMON-TDDFT / SALMON2
SALMON 2.0.0 Development Repository
☆14Updated this week
Alternatives and similar repositories for SALMON2
Users that are interested in SALMON2 are comparing it to the libraries listed below
Sorting:
- C++ implemented Coordinate Descent Full Configuration Interaction (CDFCI) package for quantum chemistry calculation.☆18Updated 5 years ago
- ☆19Updated last week
- QuantNBody : a python package for quantum chemistry/physics to manipulate many-body operators and wave functions.☆11Updated 2 months ago
- Plane-Wave density-functional theory (DFT) development for NWChemEx electronic structure software☆15Updated last week
- A collection of fortran modules and routines to support quantum many-body calculations, with a strong focus on Dynamical Mean-Field Theor…☆15Updated 4 months ago
- MultiResolution Chemistry☆31Updated last week
- LSMS is a code for scalable first principles calculations of materials using multiple scattering theory.☆28Updated this week
- Library for Green’s function based electronic structure theory calculations☆23Updated 2 weeks ago
- Matlab Simulation Package for Ab-initio Real-space Calculations☆28Updated 5 months ago
- Basic numerical tensor algebra library for distributed heterogeneous HPC platforms☆17Updated 2 years ago
- A modern C++ library for high-performance configuration interaction methods☆16Updated 2 months ago
- Program for Molecular Fock Dirac calculations☆12Updated 5 years ago
- Exchange correlation (XC) library for density functional theory (DFT) calculations in modern C++☆20Updated last month
- Reference implementation of GW☆13Updated 5 years ago
- FLOSIC code is used for performing self-interaction corrected (SIC) density functional approximation calculations. Fermi Löwdin orbital i…☆17Updated 6 months ago
- Open Source Exascale Computational Chemistry Software☆25Updated 2 weeks ago
- ☆12Updated 3 months ago
- Real-time TDDFT for Quantum-Espresso☆24Updated last year
- Accurate many-body perturbation theory calculations of the electronic structure of molecules and clusters☆42Updated last month
- RMG is an Open Source code for electronic structure calculations and modeling of materials and molecules. It is based on density function…☆48Updated this week
- GPU-accelerated Quantum ESPRESSO using CUDA FORTRAN☆62Updated 5 years ago
- GW-BSE for excited state Quantum Chemistry in a Gaussian Orbital basis, electronic spectroscopy with QM/MM, charge and energy dynamics in…☆29Updated 3 years ago
- The project represents a Python framework for computing the electron transport characteristics using the non-equilibrium Green's function…☆12Updated 6 years ago
- Library for local orbital scaling correction (LOSC).☆16Updated 10 months ago
- Code generator for simint vectorized integrals☆28Updated 2 years ago
- SPMS table of pseudopotentials☆19Updated 2 years ago
- GauXC is a modern, modular C++ library for the evaluation of quantities related to the exchange-correlation (XC) energy (e.g. potential, …☆33Updated 2 weeks ago
- Dyson equation solvers for electron propagator methods☆10Updated last month
- ☆20Updated 5 months ago
- A Python package for wave function-based quantum embedding☆34Updated last month