Alternatives and similar repositories for PHYSBO:

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

• tsudalab / combo3
  COMBO for Python 3
  ☆33Updated 2 years ago
• koji-inui / automatic-hamiltonian-design
  ☆32Updated 2 years ago
• quantumbeam / BBO-Rietveld
  Automated crystal structure analysis based on blackbox optimisation
  ☆27Updated 4 months ago
• cmsi / MateriAppsLive
  Live Debian GNU/Linux System for MateriApps Applications
  ☆54Updated this week
• matlantis-pfcc / atomistic-simulation-tutorial
  Atomistic simulation hands on tutorial on Matlantis
  ☆38Updated 3 months ago
• tsudalab / PDC
  Efficient phase diagram construction based on uncertainty sampling
  ☆14Updated 2 years ago
• hikaruri / OMXsigmaxy
  Computing anomalous Hall conductivity in OpenMX
  ☆11Updated last year
• matlantis-pfcc / matlantis-contrib
  ☆35Updated this week
• tsudalab / fmqa
  A trainable Binary Quadratic Model (BQM) as a Factorization Machine (FM)
  ☆23Updated last year
• PV-Lab / Benchmarking
  Benchmarking
  ☆26Updated 3 years ago
• pyiron / pyiron_meltingpoint
  A fully automated approach to determine the melting temperature of crystalline materials
  ☆18Updated 6 months ago
• pfnet-research / torch-dftd
  pytorch implementation of dftd2 & dftd3 (not actively maintained)
  ☆72Updated 3 months ago
• Tomoki-YAMASHITA / CrySPY
  CrySPY is a crystal structure prediction tool written in Python.
  ☆122Updated 8 months ago
• issp-center-dev / abICS
  ab-Initio Configuration Sampling tool kit (abICS)
  ☆17Updated 2 months ago
• ml-electron-project / NNfunctional
  ☆36Updated 5 years ago
• tkotani / ecalj
  The quasiparticle self-consistent GW method in the PMT method (LAPW+LMTO+Lo).
  ☆28Updated last month
• giprayogo / SHRY
  A tool for generating unique ordered structures corresponding to a given disordered structure.
  ☆16Updated last year
• spglib / spgrep
  On-the-fly generator of space-group irreducible representations
  ☆48Updated this week
• originofmatter / MatGAN
  Generative deep learning model for inorganic materials
  ☆18Updated last year
• by256 / rdfpy
  A Python module for fast computation of 2D and 3D radial distribution functions (RDFs).
  ☆27Updated last year
• mjrs33 / paper
  ☆21Updated 2 years ago
• nmardirossian / PySCF_Tutorial
  ☆29Updated 6 years ago
• mala-project / mala
  Materials Learning Algorithms. A framework for machine learning materials properties from first-principles data.
  ☆86Updated this week
• SALMON-TDDFT / SALMON
  Scientific program for first-principles electron dynamics calculations
  ☆17Updated 5 years ago
• SPARC-X / M-SPARC
  Matlab Simulation Package for Ab-initio Real-space Calculations
  ☆28Updated 3 months ago
• YoshihiroMichishita / julia
  ☆24Updated this week
• janosh / thermo
  Data-driven risk-conscious thermoelectric materials discovery
  ☆15Updated last month
• freude / NanoNet
  The project represents an extendable Python framework for the electronic structure computations based on the tight-binding method and tr…
  ☆32Updated last year
• Yamanaka-Lab-TUAT / Introduction_to_phasefield
  Pythonによるフェーズフィールド法入門 -基礎理論からデータ同化の実装まで- （丸善出版株式会社）に掲載のサンプルプログラムです。
  ☆19Updated last year
• RMGDFT / rmgdft
  RMG is an Open Source code for electronic structure calculations and modeling of materials and molecules. It is based on density function…
  ☆48Updated this week