SUMMARY.md

Table of contents

• Introduction
• Frequently Asked Questions
• Getting Involved
• Getting Help
• Database Versions
• Changes
• Code of Conduct

Methodology

• Calculation Details
  • GGA+U Calculations
  • Pseudopotentials
• Thermodynamic Stability
• Equations of State
• Electronic Structure
• Phonon Dispersion
• Diffraction Patterns
• Aqueous Stability (Pourbaix)
• Magnetic Properties
• Elastic Constants
• Dielectric Constants
• Piezoelectric Constants
• X-ray Absorption Spectra
• Surface Energies
• Suggested Substrates
• Grain Boundaries
• Related Materials

Apps

• Catalysis Explorer
• MOF Explorer
  • Downloading the Data
  • Structure Details
    • QMOF IDs
    • Structure Sources
    • Finding MOFs by Common Name
    • Structural Fidelity
  • Property Definitions
    • SMILES, MOFid, and MOFkey
    • Pore Geometry
    • Topology
    • Electronic Structure
    • Population Analyses and Bond Orders
    • Symmetry
  • Calculation Parameters
    • DFT Parameters
    • Density Functionals
    • Psuedopotentials
    • DFT Workflow
  • Version History
  • How to Cite
  • Additional Details
    • Contact
    • License
    • Acknowledgments
• Battery Explorer
• Molecules Explorer
• Synthesis Explorer

Downloading Data

• How do I download the Materials Project database?
• Differences between new and legacy API
• Using the API
  • Getting Started
  • Querying Data
  • Examples
  • Advanced Usage
  • Legacy API Users
• API Endpoint Documentation
  • Summary
  • Materials

Uploading Data

• What is MPContribs?