Alternatives and similar repositories for qe-study

Users that are interested in qe-study are comparing it to the libraries listed below

• Cloudiiink / pyw90
  A VASP and Wannier90 interfaced tool for projection analysis and fully automated dis energy window optimization
  ☆44Updated 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…
  ☆124Updated 3 years ago
• AdityaRoy-1996 / Phonopy_VESTA
  Export Eigenvectors from Phonopy format to VESTA
  ☆51Updated last year
• mxchen-2020 / kproj
  KPROJ: A Band Unfolding Program
  ☆47Updated 11 months ago
• yangjio4849 / TransOpt
  The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…
  ☆55Updated last week
• Infant83 / VASPBERRY
  Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code
  ☆78Updated 5 months ago
• kavanase / vaspup2.0
  VASP Convergence Testing (for Energy & Dielectric Constants)
  ☆56Updated 2 months ago
• kumagai-group / pydefect
  Python library for point-defect calculations in non-metallic solids based on first-principle calculations with the VASP code.
  ☆65Updated 2 months ago
• WatsonGroupTCD / Occupation-matrix-control-in-VASP
  Occupation matrix control modification VASP
  ☆53Updated 6 years ago
• QijingZheng / pyband
  band plot using python matplotlib
  ☆179Updated last year
• Chengcheng-Xiao / VASP_OPT_AXIS
  Fix lattice component(s) during relaxation in VASP
  ☆136Updated 2 months ago
• maituoy / BayesianOpt4dftu
  ☆42Updated last year
• BigBroSci-LVTHW / LVTHW
  ☆60Updated last year
• golddoushi / mcsolver
  A user friendly tools using Monte Carlo simulations for estimation of Curie temperature
  ☆90Updated 9 months ago
• yuzie007 / upho
  Band unfolding for phonons
  ☆58Updated last year
• irreducible-representations / irrep
  ☆73Updated last week
• QijingZheng / Hefei-NAMD
  ab-initio nonadiabatic molecular dynamics program
  ☆116Updated last year
• Chengcheng-Xiao / VASP2WAN90_v2_fix
  An updated version of the VASP2WANNIER90v2 interface
  ☆106Updated 2 years ago
• DerekDardzinski / vaspvis
  A highly flexible and customizable library for visualizing electronic structure data from VASP calculations.
  ☆42Updated last year
• tamaswells / VASPKIT_manual
  VASPKIT_manual markdown source!
  ☆82Updated 6 years ago
• yjzhang97 / pymatgen_bs_dos_plot
  ☆23Updated 5 years ago
• rehnd / VASP-plot-modes
  Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP
  ☆34Updated last year
• ponychen123 / Vasptools
  some toolkits for VASP
  ☆34Updated 4 years ago
• pyatb / pyatb
  Ab initio tight binding simuation package
  ☆38Updated last month
• QijingZheng / VaspPoscarMayavi
  Use 3D visualization software Mayavi to visualize VASP POSCAR file.
  ☆35Updated 2 years ago
• tamaswells / XDATCAR_toolkit
  XDATCAR_toolkit- A tool for convert XDATCAR to PDB
  ☆64Updated 6 years ago
• caizefeng / deltaspin
  A self-adaptive spin-constraining scheme based on cDFT, operating as an extension to VASP
  ☆34Updated last year
• Chengcheng-Xiao / mpiPyMC
  A python based, MPI enabled, Monte-Carlo calculation of 2D system using Metropolis algorithm.
  ☆37Updated 4 years ago
• pipidog / ONCVPSP
  Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
  ☆90Updated 6 years ago
• qtm-iisc / Twister
  ☆68Updated 2 years ago