Alternatives and similar repositories for dyson

Users that are interested in dyson are comparing it to the libraries listed below

• pernalk / GAMMCOR
  gammcor code
  ☆11Updated 6 months ago
• Yang-Laboratory / losc
  Library for local orbital scaling correction (LOSC).
  ☆16Updated last year
• DoNOF / DoNOFsw
  Donostia Natural Orbital Functional Software
  ☆20Updated 8 months ago
• obackhouse / gmtkn
  GMTKN test sets in python
  ☆11Updated 3 years ago
• xubwa / socutils
  ☆13Updated 2 months ago
• filippi-claudia / champ
  The Cornell-Holland Ab-initio Materials Package (CHAMP) is a quantum Monte Carlo suite of programs for electronic structure calculations …
  ☆20Updated last month
• Warlocat / x2camf
  SOC integrals generator with atomic mean field approximation
  ☆10Updated last month
• edeprince3 / v2rdm_casscf
  A variational 2-RDM-driven CASSCF plugin to Psi4
  ☆11Updated 4 years ago
• felipelewyee / PyNOF
  ☆14Updated 2 months ago
• QMC-Cornell / CHAMP
  Cornell-Holland Ab-initio Materials Package
  ☆16Updated last year
• TREX-CoE / trexio_tools
  Set of tools for trexio files
  ☆19Updated 3 weeks ago
• BoothGroup / Vayesta
  A Python package for wave function-based quantum embedding
  ☆34Updated this week
• jeanwsr / pyNOF
  Natural-orbital Functional based on PySCF
  ☆10Updated 11 months ago
• UFParLab / aces4
  Parallel Computational Chemistry Application
  ☆18Updated 7 years ago
• pfloos / QuAcK
  QuAcK: a software for emerging quantum electronic structure methods
  ☆28Updated this week
• mickcollins / SMFAPAC
  systematic molecular fragmentation by annihilation
  ☆11Updated 5 years ago
• sokolov-group / prism
  Python implementation of electronic structure theories for simulating spectroscopic properties
  ☆17Updated last month
• edeprince3 / hilbert
  ☆16Updated last month
• wavefunction91 / IntegratorXX
  Reusable DFT Grids for the Masses
  ☆16Updated last year
• hongzhouye / ccgto
  Correlation consistent Gaussian basis sets for solids
  ☆23Updated 2 months ago
• wangenau / eminus
  Pythonic electronic structure theory.
  ☆18Updated 2 months ago
• wasserman-group / n2v
  n2v: Density-to-potential Inversion Suite
  ☆23Updated 2 years ago
• SinaMostafanejad / OpenRDM
  An open-source library for reduced-density matrix-based analysis and computation
  ☆20Updated 2 years ago
• sanshar / StackBlock
  ☆11Updated 4 years ago
• jeanwsr / pyAutoMR
  Automatic MR based on PySCF
  ☆15Updated last month
• Multi-collinear / MCfun
  Multi-collinear functional
  ☆10Updated 5 months ago
• quan-tum / CDFCI
  C++ implemented Coordinate Descent Full Configuration Interaction (CDFCI) package for quantum chemistry calculation.
  ☆18Updated 5 years ago
• sanshar / VMC
  ☆19Updated 3 years ago
• FLOSIC / PublicRelease_2020
  FLOSIC code is used for performing self-interaction corrected (SIC) density functional approximation calculations. Fermi Löwdin orbital i…
  ☆17Updated 2 months ago
• ebylaska / PWDFT
  Plane-Wave density-functional theory (DFT) development for NWChemEx electronic structure software
  ☆15Updated last week