Alternatives and similar repositories for PAOFLOW

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

• irreducible-representations / irrep
  ☆67Updated this week
• band-unfolding / banduppy
  Python version ofthe BandUP code
  ☆25Updated 9 months ago
• QijingZheng / VaspPoscarMayavi
  Use 3D visualization software Mayavi to visualize VASP POSCAR file.
  ☆32Updated 2 years ago
• whu-maple / tbhcnn
  Prototype code of the tight-binding hamiltonian construction neural network model. Check the example_basic_method.py to construct a TB mo…
  ☆31Updated 3 years ago
• InWonYeu / interphon
  Interfacial Phonon code
  ☆28Updated 2 years ago
• rehnd / VASP-plot-modes
  Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP
  ☆33Updated last year
• cmdlab / pyGWBSE
  python workflow for GW-BSE calculation
  ☆28Updated 2 years ago
• QijingZheng / VASP_TDM
  Transition Dipole Moments from VASP WAVECAR
  ☆25Updated 2 years ago
• yuzie007 / upho
  Band unfolding for phonons
  ☆55Updated 8 months ago
• lucydot / effmass
  Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.
  ☆80Updated 2 months ago
• dkorotin / exchanges
  Exchange parameters of Heisenberg model calculation via Green's function approach
  ☆34Updated last year
• rashidrafeek / Quantum-ESPRESSO-scripts
  Python scripts to postprocess Quantum Espresso calclations.
  ☆18Updated 5 years ago
• SSCHAcode / python-sscha
  The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).
  ☆64Updated 8 months ago
• hungpham2017 / pyWannier90
  A Wannier90 python interface for VASP and PySCF
  ☆38Updated last year
• skelton-group / Phono3py-Power-Tools
  Tools for Phono(3)py power users.
  ☆34Updated last year
• zjwang11 / VASP2KP
  to compute kp parameters and Lande g-factors directly from the VASP wavefunctions. Ref: Zhang et al., Chin. Phys. Lett. 40, 127101 (2023…
  ☆25Updated last month
• DMFTwDFT-project / DMFTwDFT
  DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various Density Functional Theory packages
  ☆58Updated 3 years ago
• QijingZheng / VaspVib2XSF
  Visualize vibrational modes from VASP calculations
  ☆42Updated 6 months ago
• MaterSim / vasprun
  quick analysis of vasp calculation
  ☆36Updated last year
• mturiansky / nonrad
  Implementation for computing nonradiative recombination rates in semiconductors
  ☆48Updated 9 months ago
• mailhexu / TB2J
  a python package for computing magnetic interaction parameters
  ☆80Updated this week
• wannier-developers / wannier-tutorials
  A repository hosting materials used during Wannier-related tutorials and schools
  ☆41Updated last year
• tdep-developers / tdep
  The Temperature Dependent Effective Potentials (TDEP) code
  ☆85Updated 2 weeks ago
• Infant83 / VASPBERRY
  Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code
  ☆70Updated 10 months ago
• AdityaRoy-1996 / Phonopy_VESTA
  Export Eigenvectors from Phonopy format to VESTA
  ☆45Updated 6 months ago
• QG-phy / TBSOC
  Calculate ab initio spin-orbital coupling strength for Wannier tight-binding models.
  ☆26Updated last year
• zjwang11 / IRVSP
  IRVSP: to obtain irreducible representations of electronic states in the VASP, Comput. Phys. Comm. 261, 107760 (2021). https://doi.org/10…
  ☆116Updated 2 years ago
• aiidateam / qe-tools
  A set of useful tools for Quantum ESPRESSO
  ☆33Updated last month
• JMSkelton / ModeMap
  A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.
  ☆44Updated last year
• OkanKoeksal / Spin-Texture-VASP
  Spin Texture contains a C++-code as well as gnuplot scripts for generating and plotting spin textures
  ☆22Updated 3 years ago