Alternatives and similar repositories for pivotpy:

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

• Chengcheng-Xiao / VASP_LOL
  VASP - Localized Orbital Locator + Electron Localizability Indicator
  ☆17Updated 2 years ago
• DefAP / defap
  DefAP is a program developed to facilitate the exploration of a material's defect chemistry. A large number of features are provided and …
  ☆20Updated last year
• NU-CEM / ThermoPot
  Python package for calculating thermodynamic potentials from first-principles calculations
  ☆14Updated last year
• InWonYeu / interphon
  Interfacial Phonon code
  ☆26Updated 2 years ago
• hitliaomq / ELASTIC3rd
  Calculate 3rd order elastic constant.
  ☆13Updated 3 weeks ago
• MahdiDavari / FPTE
  The FPTE package is a collection of tools for finite pressure temperature elastic constants calculation. Features include, but are not l…
  ☆16Updated 3 months ago
• KeivanS / Anharmonic-lattice-dynamics
  Set of codes to extract force constants from force-displacements data, calculate phonon dispersion (FOCEX) and thermal transport properti…
  ☆14Updated 2 weeks ago
• ac-dias / wantibexos
  WanTiBEXOS code repository
  ☆12Updated 7 months ago
• harrisonlabollita / phononTools
  Python program for analyzing the output files of phonopy.
  ☆13Updated 3 years ago
• mauropalumbo75 / pyqha
  A python project for quasi-harmonic properties calculations
  ☆9Updated 7 years ago
• Chengcheng-Xiao / WOBSTER
  Wannier-orbital Basis Suite Towards Electronic-Structure Reconstruction
  ☆15Updated last year
• qtm-iisc / CoFFEE
  Corrections for formation energy and eigenvalues for charged defect simulations
  ☆13Updated 2 years ago
• romankempt / hetbuilder
  Builds 2D heterostructures via coincidence lattice theory.
  ☆14Updated last year
• tdep-developers / tdep-tutorials
  TDEP Tutorials
  ☆29Updated this week
• flokno / tools.tdep
  ☆19Updated 4 months ago
• ttadano / DistortPerovskite
  Script to generate distorted perovskite structures
  ☆11Updated last year
• QuantumMaterialsModelling / bands4vasp
  bands4vasp -- post processing package for the analysis of unfolded eigenstates in VASP, and much more: band structures, 2D and 3D Fermi s…
  ☆12Updated 3 years ago
• Baijianlu / AICON2
  AICON2: A program for calculating transport properties quickly and accurately
  ☆15Updated last year
• rashidrafeek / Quantum-ESPRESSO-scripts
  Python scripts to postprocess Quantum Espresso calclations.
  ☆18Updated 5 years ago
• AdityaRoy-1996 / Projected-Bands-in-Quantum-Espresso
  Projected Electronic Bands in Quantum Espresso
  ☆14Updated last year
• JaGeo / AtomicContributions
  Vizualisation of Atomic Contributions to Phonon Modes
  ☆10Updated 5 months ago
• TnakaTnakaTnaka / PHNEGF
  Python scripts to investigate the phonon transport for perfect crystal on the basis of NEGF theory
  ☆20Updated 4 years ago
• ttadano / alamode_tutorial
  Tutorial files for alamode
  ☆12Updated 8 months ago
• conodipaola / kg4vasp
  Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP
  ☆23Updated 4 years ago
• rubel75 / mstar
  Effective mass calculation with DFT
  ☆16Updated 6 months ago
• Sassafrass6 / XtraCrysPy
  A crystallographic visualizer for Python, compatible with files from common softwares like Quantum ESPRESSO, VASP, CP2K, etc.
  ☆19Updated 6 months ago
• K4ys4r / BoltzTraP_Tools
  BoltzTraP_Tools is an interface written using Python 2 language. It allows to parse and plot BoltzTraP output DATA
  ☆19Updated 4 years ago
• skelton-group / Phono3py-Power-Tools
  Tools for Phono(3)py power users.
  ☆33Updated last year
• gabkrenzer / PhononFlow
  A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.
  ☆33Updated 2 years ago
• WOOHYUNHAN / phononTB
  Construct phonon tight-binding model and calculate its topological properties
  ☆26Updated 5 years ago