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
  ☆15Updated 2 years ago
• hitliaomq / ELASTIC3rd
  Calculate 3rd order elastic constant.
  ☆13Updated 3 years ago
• QuantumMaterialsModelling / bands4vasp
  bands4vasp -- post processing package for the analysis of unfolded eigenstates in VASP, and much more: band structures, 2D and 3D Fermi s…
  ☆10Updated 3 years ago
• mauropalumbo75 / pyqha
  A python project for quasi-harmonic properties calculations
  ☆9Updated 6 years ago
• SSlakeLabTiangong / 2020_webinar
  ☆11Updated 4 years ago
• henniggroup / electronic-structure-visualization
  Visualizations
  ☆13Updated 3 years ago
• qtm-iisc / CoFFEE
  Corrections for formation energy and eigenvalues for charged defect simulations
  ☆11Updated last year
• MahdiDavari / FPTE
  The FPTE package is a collection of tools for finite pressure temperature elastic constants calculation. Features include, but are not l…
  ☆15Updated this week
• 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 9 months ago
• Chengcheng-Xiao / Periodic_NBO
  Natural Bond Orbital algorithm to handle systems characterized by periodic symmetry
  ☆20Updated 3 years ago
• flokno / tools.tdep
  ☆16Updated 3 weeks ago
• KeivanS / Anharmonic-lattice-dynamics
  Set of codes to extract force constants from force-displacements data, calculate phonon dispersion (FOCEX) and thermal transport properti…
  ☆11Updated this week
• NU-CEM / ThermoPot
  Python package for calculating thermodynamic potentials from first-principles calculations
  ☆14Updated last year
• InWonYeu / interphon
  Interfacial Phonon code
  ☆25Updated 2 years ago
• Sassafrass6 / XtraCrysPy
  A crystallographic visualizer for Python, compatible with files from common softwares like Quantum ESPRESSO, VASP, CP2K, etc.
  ☆18Updated 3 months ago
• romankempt / hetbuilder
  Builds 2D heterostructures via coincidence lattice theory.
  ☆13Updated last year
• Chengcheng-Xiao / WOBSTER
  Wannier-orbital Basis Suite Towards Electronic-Structure Reconstruction
  ☆15Updated last year
• rashidrafeek / Quantum-ESPRESSO-scripts
  Python scripts to postprocess Quantum Espresso calclations.
  ☆18Updated 4 years ago
• AdityaRoy-1996 / Projected-Bands-in-Quantum-Espresso
  Projected Electronic Bands in Quantum Espresso
  ☆13Updated last year
• harrisonlabollita / phononTools
  Python program for analyzing the output files of phonopy.
  ☆13Updated 3 years ago
• ShuangLeung / STM_2DScan
  STM-2DScan.py is a postprocessing script for VASP code to generate STM images based on DFT-calculations. It firstly imports volumetric d…
  ☆12Updated 4 years ago
• tdep-developers / tdep-tutorials
  TDEP Tutorials
  ☆24Updated last month
• bjmorgan / py-sc-fermi
  py-sc-fermi is a materials modelling code for calculating self-consistent Fermi energies and defect concentrations under thermodynamic eq…
  ☆25Updated this week
• JaGeo / AtomicContributions
  Vizualisation of Atomic Contributions to Phonon Modes
  ☆10Updated 2 months ago
• Volkov-da / curie_calculator
  Magnetic critical temperature Calculator
  ☆17Updated 9 months ago
• aiida-vasp / parsevasp
  A general parser for VASP
  ☆13Updated this week
• rubel75 / fold2Bloch-VASP
  Unfolding the band structure of a supercell obtained with VASP
  ☆24Updated 2 years ago
• hello-arun / tutorials
  Tutorials of codes such as VASP, Quantum Espresso and Lammps
  ☆12Updated this week
• TMM-TUDA / Automatic-wannier-flow
  Automatic construction of wannier functions for any 3D transition metal based system with or without SOC
  ☆12Updated 2 years ago
• ttadano / alamode_tutorial
  Tutorial files for alamode
  ☆12Updated 5 months ago