Alternatives and similar repositories for GeCCo-public

Users that are interested in GeCCo-public are comparing it to the libraries listed below

• Warlocat / x2camf
  SOC integrals generator with atomic mean field approximation
  ☆10Updated 4 months ago
• sokolov-group / prism
  Python implementation of electronic structure theories for simulating spectroscopic properties
  ☆18Updated last week
• xubwa / socutils
  ☆13Updated last month
• BoothGroup / Vayesta
  A Python package for wave function-based quantum embedding
  ☆37Updated this week
• hongzhouye / ccgto
  Correlation consistent Gaussian basis sets for solids
  ☆24Updated 6 months ago
• QMCPACK / pseudopotentiallibrary
  Repository for PseudopotentialLibrary.org website and database
  ☆15Updated 2 months ago
• MatthewRHermes / mrh
  MRH's research code
  ☆25Updated last week
• awhite862 / wick
  Symbolic manipulation of operator strings for quantum chemistry
  ☆21Updated 2 years ago
• QMC-Cornell / shci
  Arrow - Fast Semistochastic Heat Bath Configuration Interaction Solver (SHCI)
  ☆33Updated last month
• gayverjr / opencap
  An open source program for the description of metastable electronic states in molecules.
  ☆22Updated 7 months ago
• piecuch-group / ccpy
  Coupled-cluster package written in Python.
  ☆46Updated last week
• adc-connect / adcc
  adcc: Seamlessly connect your program to ADC
  ☆38Updated 2 months ago
• zhendongli2008 / qcmpodmrg
  An MPO-based DMRG code for Quantum Chemistry
  ☆13Updated 7 years ago
• sanshar / StackBlock
  ☆11Updated 4 years ago
• sanshar / Dice
  ☆60Updated 5 months ago
• DoNOF / DoNOFsw
  Donostia Natural Orbital Functional Software
  ☆21Updated last month
• gkclab / libdmet_preview
  A library of density matrix embedding theory (DMET).
  ☆37Updated 10 months ago
• fevangelista / Quantum-Chemistry-Foundations
  ☆12Updated 9 months ago
• obackhouse / gmtkn
  GMTKN test sets in python
  ☆11Updated 3 years ago
• edeprince3 / v2rdm_casscf
  A variational 2-RDM-driven CASSCF plugin to Psi4
  ☆11Updated 4 years ago
• NASymmetry / MolSym
  I can't believe it's NonAbelian!
  ☆30Updated 4 months ago
• ajz34 / PyCrawfordProgProj
  Crawford's Quantum Chemistry Exercises by Python approach
  ☆32Updated 3 years ago
• wangenau / eminus
  Pythonic electronic structure theory.
  ☆21Updated this week
• YiHeXu517 / Kylin-V
  TD-DMRG and VHCI package
  ☆10Updated 4 months ago
• wavefunction91 / IntegratorXX
  Reusable DFT Grids for the Masses
  ☆19Updated 2 months ago
• aakunitsa / GW-approximation
  Reference implementation of GW
  ☆13Updated 6 years ago
• rohkeaID / elk-w90-improved
  An interface for ELK-Wannier90 calculations
  ☆16Updated 5 years ago
• TREX-CoE / trexio_tools
  Set of tools for trexio files
  ☆19Updated last month
• jeanwsr / pyAutoMR
  Automatic MR based on PySCF
  ☆16Updated last month
• pfloos / QuAcK
  QuAcK: a software for emerging quantum electronic structure methods
  ☆30Updated this week