Yang-Laboratory / loscLinks
Library for local orbital scaling correction (LOSC).
☆17Updated last year
Alternatives and similar repositories for losc
Users that are interested in losc are comparing it to the libraries listed below
Sorting:
- Donostia Natural Orbital Functional Software☆22Updated 2 weeks ago
- The Cornell-Holland Ab-initio Materials Package (CHAMP) is a quantum Monte Carlo suite of programs for electronic structure calculations …☆20Updated last week
- Cornell-Holland Ab-initio Materials Package☆17Updated last year
- ☆13Updated 2 weeks ago
- Dyson equation solvers for Green's function methods☆11Updated this week
- systematic molecular fragmentation by annihilation☆11Updated 6 years ago
- GMTKN test sets in python☆11Updated 4 years ago
- Set of tools for trexio files☆19Updated 3 months ago
- n2v: Density-to-potential Inversion Suite☆24Updated 3 years ago
- An open-source library for reduced-density matrix-based analysis and computation☆20Updated 2 years ago
- Parallel Computational Chemistry Application☆18Updated 8 years ago
- Plane-Wave density-functional theory (DFT) development for NWChemEx electronic structure software☆14Updated this week
- Correlation consistent Gaussian basis sets for solids☆25Updated 8 months ago
- SOC integrals generator with atomic mean field approximation☆10Updated 6 months ago
- Python implementation of electronic structure theories for simulating spectroscopic properties☆20Updated this week
- QuAcK: a software for emerging quantum electronic structure methods☆30Updated this week
- adcc: Seamlessly connect your program to ADC☆38Updated this week
- gammcor code☆11Updated 4 months ago
- Reusable DFT Grids for the Masses☆19Updated this week
- Automatic MR based on PySCF☆16Updated 2 weeks ago
- An open source program for the description of metastable electronic states in molecules.☆24Updated 9 months ago
- ☆15Updated 2 months ago
- Hartree-Fock Python☆20Updated 3 years ago
- Pythonic electronic structure theory.☆23Updated last week
- A variational 2-RDM-driven CASSCF plugin to Psi4☆11Updated 4 years ago
- Natural-orbital Functional based on PySCF☆10Updated last year
- A modern C++ library for high-performance configuration interaction methods☆19Updated last week
- MRH's research code☆25Updated this week
- Coupled Cluster for solids. Mirror of https://gitlab.cc4s.org/cc4s/cc4s☆24Updated 3 months ago
- Arrow - Fast Semistochastic Heat Bath Configuration Interaction Solver (SHCI)☆34Updated 3 months ago