Alternatives and similar repositories for qcmpodmrg

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

• gkclab / libdmet_preview
  A library of density matrix embedding theory (DMET).
  ☆37Updated 10 months ago
• ZhuGroup-Yale / fcdmft
  Ab initio full cell dynamical mean-field theory (DMFT) and GW+DMFT for solids
  ☆39Updated 2 years ago
• hczhai / fci-siso
  State Interaction Spin-Orbit (SISO) Method for CASSCF and FCI
  ☆13Updated last month
• hongzhouye / ccgto
  Correlation consistent Gaussian basis sets for solids
  ☆24Updated 6 months ago
• Warlocat / x2camf
  SOC integrals generator with atomic mean field approximation
  ☆10Updated 4 months ago
• QMC-Cornell / shci
  Arrow - Fast Semistochastic Heat Bath Configuration Interaction Solver (SHCI)
  ☆33Updated last month
• awhite862 / wick
  Symbolic manipulation of operator strings for quantum chemistry
  ☆21Updated 2 years ago
• block-hczhai / pyblock3-preview
  pyblock3: an efficient python block-sparse tensor library
  ☆28Updated 3 months ago
• QMC-Cornell / CHAMP
  Cornell-Holland Ab-initio Materials Package
  ☆17Updated last year
• xubwa / socutils
  ☆13Updated last month
• msaitow / SecondQuantizationAlgebra
  Software package to handle the many-fermionic operator
  ☆16Updated 12 years ago
• aakunitsa / GW-approximation
  Reference implementation of GW
  ☆13Updated 6 years ago
• BoothGroup / Vayesta
  A Python package for wave function-based quantum embedding
  ☆37Updated last week
• theochem / fanpy
  Projectively-optimized geminal and "fancyCI" wavefunctions
  ☆17Updated 3 years ago
• cc-ats / qed-tddft
  Quantum-electrodynamical Time-dependent Density Functional Theory Within Gaussian Atomic Basis
  ☆14Updated 6 months ago
• DoNOF / DoNOFsw
  Donostia Natural Orbital Functional Software
  ☆21Updated last month
• hungpham2017 / pDMET
  Density matrix embedding theory for periodic systems
  ☆18Updated 4 years ago
• nickirk / pymes
  PyMES is a package for developing new methods in quantum chemistry.
  ☆13Updated this week
• YiHeXu517 / Kylin-V
  TD-DMRG and VHCI package
  ☆10Updated 4 months ago
• TRIQS / solid_dmft
  solid_dmft is a versatile python wrapper to perform DFT+DMFT calculations utilizing the TRIQS software library.
  ☆38Updated this week
• sanshar / Dice
  ☆60Updated 5 months ago
• materialstheory / soliDMFT
  soliDMFT allows to perform charge self-consistent DFT+DMFT calculations by utilizing the triqs library and VASP.
  ☆15Updated 3 years ago
• ValeevGroup / SeQuant1
  SeQuant: second quantization toolkit
  ☆16Updated 3 years ago
• zhendongli2008 / Lecture-Notes-On-Quantum-Chemistry
  Quantum Chemistry Course @ BNU2021
  ☆22Updated 3 years ago
• rohkeaID / elk-w90-improved
  An interface for ELK-Wannier90 calculations
  ☆16Updated 5 years ago
• cc4s / cc4s
  Coupled Cluster for solids. Mirror of https://gitlab.cc4s.org/cc4s/cc4s
  ☆23Updated 3 weeks ago
• jeanwsr / pyNOF
  Natural-orbital Functional based on PySCF
  ☆10Updated last year
• sokolov-group / prism
  Python implementation of electronic structure theories for simulating spectroscopic properties
  ☆18Updated last week
• sanshar / StackBlock
  ☆11Updated 4 years ago
• theochem / ModelHamiltonian
  Generate 1- and 2-electron integrals so that molecular quantum chemistry software can be used for model Hamiltonians.
  ☆34Updated last week