Alternatives and similar repositories for pymes

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

• msaitow / SecondQuantizationAlgebra
  Software package to handle the many-fermionic operator
  ☆15Updated 11 years ago
• BoothGroup / Vayesta
  A Python package for wave function-based quantum embedding
  ☆34Updated last week
• ZhuGroup-Yale / fcdmft
  Ab initio full cell dynamical mean-field theory (DMFT) and GW+DMFT for solids
  ☆36Updated 2 years ago
• 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)
  ☆29Updated 2 years ago
• hongzhouye / ccgto
  Correlation consistent Gaussian basis sets for solids
  ☆23Updated 3 weeks ago
• hczhai / fci-siso
  State Interaction Spin-Orbit (SISO) Method for CASSCF and FCI
  ☆11Updated last year
• gkclab / libdmet_preview
  A library of density matrix embedding theory (DMET).
  ☆36Updated 4 months ago
• xubwa / socutils
  ☆13Updated last week
• fevangelista / wicked
  A Wick theorem kernel written in C++ and interfaced with Python
  ☆44Updated 4 months ago
• Warlocat / x2camf
  SOC integrals generator with atomic mean field approximation
  ☆10Updated last month
• zhendongli2008 / Lecture-Notes-On-Quantum-Chemistry
  Quantum Chemistry Course @ BNU2021
  ☆22Updated 2 years ago
• sanshar / Dice
  ☆52Updated last week
• gayverjr / opencap
  An open source program for the description of metastable electronic states in molecules.
  ☆22Updated last month
• fevangelista / Quantum-Chemistry-Foundations
  ☆10Updated 4 months ago
• zhendongli2008 / qcmpodmrg
  An MPO-based DMRG code for Quantum Chemistry
  ☆12Updated 6 years ago
• block-hczhai / pyblock3-preview
  pyblock3: an efficient python block-sparse tensor library
  ☆27Updated last year
• piecuch-group / ccpy
  Coupled-cluster package written in Python.
  ☆40Updated last month
• JoonhoLee-Group / ipie
  ipie stands for Intelligent Python-based Imaginary-time Evolution with a focus on simplicity and speed.
  ☆57Updated this week
• sokolov-group / prism
  Python implementation of electronic structure theories for simulating spectroscopic properties
  ☆17Updated this week
• ru-ccmt / eDMFT
  Haule's Repository for combination of Density Functional Theory and Embedded Dynamical Mean Field Theory implementation (Python3 version)
  ☆29Updated 4 months ago
• QMCPACK / pseudopotentiallibrary
  Repository for PseudopotentialLibrary.org website and database
  ☆15Updated 11 months ago
• zhendongli2008 / zmpo_dmrg
  ZMPO-DMRG: A Parallel Fock-Space ab DMRG code based on MPO for Quantum Chemistry Hamiltonian
  ☆11Updated 5 years ago
• sunqm / pbchf
  An example to implement PBC SCF
  ☆14Updated 6 years ago
• MatthewRHermes / mrh
  MRH's research code
  ☆25Updated last week
• adc-connect / adcc
  adcc: Seamlessly connect your program to ADC
  ☆36Updated last week
• lauvergn / ElVibRot-TnumTana
  General quantum dynamics code using curvilinear coordinates and a numerical kinetic energy operator (with Tnum) : (i) Vibrational levels,…
  ☆10Updated last year
• ak-ustutt / GeCCo-public
  public version of our general contraction code project
  ☆11Updated last month
• TREX-CoE / qmcchem2
  QMC=Chem version 2
  ☆19Updated 2 months ago
• aakunitsa / GW-approximation
  Reference implementation of GW
  ☆13Updated 5 years ago