Repositories list

• Design-Test-Make-Analyze

  Public
  The ‘Design-Test-Make-Analyze’ paradigm features a combination of different candidate prediction algorithms from structure, oxidation state, to pathway prediction, to improve candidate selection efficiency towards experimental realization.

  PureBasic

  •

  MIT License

  •2•0•0•0•Updated Jun 14, 2024Jun 14, 2024

• reaction-network

  Public
  Forked from original branch for ABO3 work with synthesizability

  Python

  •

  Other

  •18•0•0•0•Updated May 28, 2024May 28, 2024

• Fast-Universal-CSP-Platform

  Public
  Jupyter Notebook

  •1•0•0•0•Updated Mar 13, 2024Mar 13, 2024

• Constrained-Multi-Objective-Optimization-for-Materials-Discovery

  Public
  Jupyter Notebook

  •

  MIT License

  •6•8•0•0•Updated Jan 16, 2024Jan 16, 2024

• Poshcar

  Public
  Quick and dirty crystal structure manipulation routines, optimized for use with VASP

  Jupyter Notebook

  •1•0•0•0•Updated Jan 10, 2024Jan 10, 2024

• Harnessing-GPT-3.5-for-Text-Parsing-in-Solid-State-Synthesis-case-study-of-ternary-chalchogenides

  Public
  Jupyter Notebook

  •1•2•0•0•Updated Dec 12, 2023Dec 12, 2023

• Styrene-Terpolymer-Optimization

  Public
  Jupyter Notebook

  •1•0•0•0•Updated Nov 7, 2023Nov 7, 2023

• opentrons-balance

  Public
  Integration of a mass balance with the Opentrons robot

  chemistrylab-automationmaterials-science

  Jupyter Notebook

  •0•2•0•0•Updated Aug 22, 2023Aug 22, 2023

• SC_model

  Public
  PureBasic

  •2•0•0•0•Updated Jul 21, 2023Jul 21, 2023

• Machine_Learning_for_Thermoelectric_Materials

  Public
  Jupyter Notebook

  •2•0•0•0•Updated Jul 13, 2023Jul 13, 2023

• pHbot

  Public
  General "physics-informed" ML-driven pH adjustment robot

  Jupyter Notebook

  •

  GNU General Public License v3.0

  •4•0•0•0•Updated Jul 13, 2023Jul 13, 2023

• May-2023-Polymer-ML-SI

  Public
  Polymer-ML Manuscript SI Files

  Jupyter Notebook

  •1•0•0•0•Updated May 15, 2023May 15, 2023

• Opentrons-ProxyViscometer

  Public
  Protocol files to use the OT-2 Opentrons robot as a proxy viscometer

  Python

  •1•3•0•0•Updated Mar 23, 2023Mar 23, 2023

• synthesizability-ranking-filter

  Public
  Synthesizability ranking filter that ranks the candidates according to their synthesizability score

  Python

  •1•0•0•0•Updated Feb 1, 2023Feb 1, 2023