x2dhf / x2dhf
Two-Dimensional Finite Difference Hartree-Fock Program
☆13Updated last month
Related projects: ⓘ
- Cornell-Holland Ab-initio Materials Package☆15Updated last month
- Arrow - Fast Semistochastic Heat Bath Configuration Interaction Solver (SHCI)☆24Updated last year
- ☆11Updated 3 weeks ago
- Coupled Cluster for solids. Mirror of https://gitlab.cc4s.org/cc4s/cc4s☆18Updated 2 months ago
- ZMPO-DMRG: A Parallel Fock-Space ab DMRG code based on MPO for Quantum Chemistry Hamiltonian☆10Updated 4 years ago
- soliDMFT allows to perform charge self-consistent DFT+DMFT calculations by utilizing the triqs library and VASP.☆14Updated 2 years ago
- solid_dmft is a versatile python wrapper to perform DFT+DMFT calculations utilizing the TRIQS software library.☆32Updated last week
- Reference implementation of GW☆13Updated 5 years ago
- An MPO-based DMRG code for Quantum Chemistry☆12Updated 6 years ago
- Arbitrary order exchange-correlation functional derivatives using JAX.☆21Updated 4 years ago
- Correlation consistent Gaussian basis sets for solids☆22Updated 4 months ago
- Abinitio Dynamical Vertex Approximation☆13Updated 4 years ago
- A library of density matrix embedding theory (DMET).☆28Updated last month
- Quantum-electrodynamical Time-dependent Density Functional Theory Within Gaussian Atomic Basis☆12Updated last year
- Ab initio full cell dynamical mean-field theory (DMFT) and GW+DMFT for solids☆32Updated last year
- An interface for ELK-Wannier90 calculations☆16Updated 3 years ago
- Density matrix embedding theory for periodic systems☆15Updated 2 years ago
- Repository for PseudopotentialLibrary.org website and database☆14Updated 2 months ago
- Materials used in a school on QMC methods☆26Updated 5 years ago
- Add on-site SOC to Wannier Hamiltonian.☆14Updated 3 years ago
- interacting Dynamic Electrons Approach☆26Updated last month
- Symbolic manipulation of operator strings for quantum chemistry☆17Updated last year
- Plane-Wave density-functional theory (DFT) development for NWChemEx electronic structure software☆15Updated 3 weeks ago
- A collection of fortran modules and routines to support quantum many-body calculations, with a strong focus on Dynamical Mean-Field Theor…☆14Updated last month
- Hartree-Fock Python☆17Updated last year
- Python modules for electron–phonon models☆29Updated last week
- A set of ipython and c++ tutorials☆18Updated 3 months ago
- A poor man's density functional theory program☆13Updated last week
- A C++ library for evaluating non-orthogonal matrix elements in electronic structure☆24Updated 9 months ago
- Equilibrium ED solver for finite fermionic models that can compute Keldysh Green's functions☆10Updated 8 months ago