Alternatives and similar repositories for gavrog

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

• QMCPACK / qmcpack_workshop_2019
  QMCPACK Users Workshop 2019
  ☆13Updated 6 years ago
• QMCPACK / qmc_workshop_2021
  Files for QMC Workshop 2021
  ☆58Updated 4 years ago
• quantum-tinkerer / qsymm
  A mirror of https://gitlab.kwant-project.org/qt/qsymm
  ☆40Updated 2 months ago
• lab-cosmo / SA-GPR
  ☆21Updated 6 years ago
• WagnerGroup / pyqmc
  Python library for real space quantum Monte Carlo
  ☆96Updated this week
• spglib / spgrep
  On-the-fly generator of space-group irreducible representations
  ☆56Updated last week
• nmardirossian / PySCF_Tutorial
  ☆30Updated 7 years ago
• QEF / SternheimerGW
  many-body perturbation theory without empty states
  ☆12Updated 7 years ago
• Sassafrass6 / PAOFLOW
  Utility to construct and operate on Hamiltonians from the Projections of DFT wave functions on Atomic Orbital bases (PAO)
  ☆24Updated last year
• aspuru-guzik-group / DiffiQult
  A fully autodifferentiable and variational HF
  ☆42Updated 5 years ago
• Frost-group / PolaronMobility.jl
  Feynman's variational path-integral model for the Fröhlich polaron. Calculates temperature dependent polaron mobilities, and other polaro…
  ☆32Updated 5 months ago
• ncfrey / pytopomat
  Python Topological Materials (pytopomat) is a code for easy, high-throughput analysis of topological materials.
  ☆30Updated 4 years ago
• f-fathurrahman / ImplementingDFT
  Draft for my book about implementing density functional theory
  ☆20Updated 8 months ago
• pekkosk / hotbit
  ASE density-functional tight-binding calculator
  ☆68Updated 10 months ago
• iDEA-org / iDEA
  interacting Dynamic Electrons Approach
  ☆28Updated last month
• iamc / ML-CM-2019
  Machine Learning in Condensed Matter Physics 2019 course repository
  ☆61Updated 6 years ago
• WMD-group / CarrierCapture.jl
  Julia package to compute trap-assisted electron and hole capture in semiconductors
  ☆57Updated 4 months ago
• DMFTwDFT-project / DMFTwDFT3
  A framework to treat strongly correlated materials using beyond-DFT methods
  ☆25Updated 5 years ago
• MineralsCloud / qe-demystify
  Demystify the undocumented Quantum ESPRESSO input/output
  ☆12Updated last year
• tsdev / spinw
  SpinW Matlab library for spin wave calculation
  ☆31Updated last year
• santoshkumarradha / pysktb
  Scientific Python package for solving Slater Koster tight-binding topological hamiltonian
  ☆56Updated 2 years ago
• tkotani / ecalj
  The quasiparticle self-consistent GW method in the PMT method (LAPW+LMTO+Lo).
  ☆34Updated 2 weeks ago
• google / differentiable-atomistic-potentials
  Automatically differentiable atomistic potentials for molecular simulations
  ☆56Updated 7 years ago
• ZhuGroup-Yale / fcdmft
  Ab initio full cell dynamical mean-field theory (DMFT) and GW+DMFT for solids
  ☆39Updated 2 years ago
• jarvist / Julia-Phonons
  Julia codes to play with Phonons
  ☆24Updated 7 years ago
• Z2PackDev / Z2Pack
  A tool for calculating topological invariants.
  ☆93Updated 9 months ago
• jrbp / pysotropy
  python interface to isotropy
  ☆15Updated 5 years ago
• lkwagner / StochasticSchool
  Materials used in a school on QMC methods
  ☆26Updated 6 years ago
• TRIQS / solid_dmft
  solid_dmft is a versatile python wrapper to perform DFT+DMFT calculations utilizing the TRIQS software library.
  ☆38Updated last week
• hungpham2017 / pyWannier90
  A Wannier90 python interface for VASP and PySCF
  ☆40Updated last month