Alternatives and similar repositories for pyphotonics

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

• ertekin-research-group / VTAnDeM
  Toolkit for visualizing phase stability and defects diagrams from DFT calculations of multicomponent materials.
  ☆16Updated last year
• skelton-group / Phono3py-Power-Tools
  Tools for Phono(3)py power users.
  ☆33Updated last year
• bjmorgan / py-sc-fermi
  py-sc-fermi is a materials modelling code for calculating self-consistent Fermi energies and defect concentrations under thermodynamic eq…
  ☆28Updated 4 months ago
• rashidrafeek / Quantum-ESPRESSO-scripts
  Python scripts to postprocess Quantum Espresso calclations.
  ☆18Updated 5 years ago
• tdep-developers / tdep-tutorials
  TDEP Tutorials
  ☆29Updated last month
• MDIL-SNU / AMP2
  ☆20Updated last year
• cmdlab / pyGWBSE
  python workflow for GW-BSE calculation
  ☆28Updated 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…
  ☆13Updated 3 years ago
• Sassafrass6 / XtraCrysPy
  A crystallographic visualizer for Python, compatible with files from common softwares like Quantum ESPRESSO, VASP, CP2K, etc.
  ☆20Updated 7 months ago
• caizefeng / deltaspin
  A self-adaptive spin-constraining scheme based on cDFT, operating as an extension to VASP
  ☆29Updated 6 months ago
• Chengcheng-Xiao / Periodic_NBO
  Natural Bond Orbital algorithm to handle systems characterized by periodic symmetry
  ☆20Updated 3 years ago
• perturbo-code / perturbopy
  Suite of Python scripts for Perturbo testing and postprocessing
  ☆11Updated last week
• mturiansky / wavecar2unk
  Converts the VASP WAVECAR to UNK files for wannier90.
  ☆23Updated 4 years ago
• flokno / tools.tdep
  ☆19Updated 4 months ago
• JMSkelton / ModeMap
  A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.
  ☆41Updated last year
• KeivanS / Anharmonic-lattice-dynamics
  Set of codes to extract force constants from force-displacements data, calculate phonon dispersion (FOCEX) and thermal transport properti…
  ☆15Updated last month
• 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…
  ☆13Updated 5 years ago
• Chengcheng-Xiao / Tools
  DFT post processing tools
  ☆24Updated 9 months ago
• romankempt / hetbuilder
  Builds 2D heterostructures via coincidence lattice theory.
  ☆14Updated last year
• rubel75 / fold2Bloch-VASP
  Unfolding the band structure of a supercell obtained with VASP
  ☆25Updated 2 years ago
• TnakaTnakaTnaka / PHNEGF
  Python scripts to investigate the phonon transport for perfect crystal on the basis of NEGF theory
  ☆21Updated 4 years ago
• usnistgov / tb3py
  TB3Py: Two- and three-body tight-binding calculations for materials
  ☆17Updated 7 months ago
• ninarina12 / phononDoS_tutorial
  Code repository for a tutorial based on the "Direct prediction of phonon density of states with Euclidean neural networks"
  ☆28Updated last year
• Quantum-Dynamics-Hub / pyxaid2
  ☆12Updated 7 years ago
• gabkrenzer / PhononFlow
  A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.
  ☆34Updated 2 years ago
• ttadano / alamode_tutorial
  Tutorial files for alamode
  ☆12Updated 9 months 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 2 weeks ago
• ttadano / DistortPerovskite
  Script to generate distorted perovskite structures
  ☆11Updated last year
• MaterSim / vasprun
  quick analysis of vasp calculation
  ☆35Updated 11 months ago
• bzkarimi / VASP
  Practical guide on how to use VASP
  ☆19Updated 4 years ago