7. A tool to retrieve crystallographic data from databases (getcif)ΒΆ

  • 7.1. Introduction
  • 7.2. Tutorial
    • Getting an API key
    • Prepare an input parameter file
    • Obtaining data
  • 7.3. Command reference
    • getcif
  • 7.4. File format
    • Input parameter file
  • 7.5. Parameter List
    • Search conditions (properties)
    • Data to retrive (fields)
    • Troubleshooting

cif2x Users Guide

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Contents:

  • Input file generator for first-principles calculations (cif2x)
    • 1. Introduction
    • 2. Installation and basic usage
    • 3. Tutorial
    • 4. Command reference
    • 5. File format
    • 6. Extension guide
    • 7. A tool to retrieve crystallographic data from databases (getcif)

Related Topics

  • Documentation overview
    • Input file generator for first-principles calculations (cif2x)
      • Previous: 6. Extension guide
      • Next: 7.1. Introduction

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