atomify-examples-template/examples.json at main · andeplane/atomify-examples-template · GitHub

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{
  "baseUrl": "https://raw.githubusercontent.com/andeplane/atomify-examples-template/main",
  "title": "Diffusion examples",
  "descriptionFile": "description.md",
  "examples": [
      {
          "id": "2d-msd-diffusion",
          "title": "2D diffusion MSD",
          "description": "We measure the diffusion coefficient using the mean square displacement.",
          "analysisDescription": "# About this simulation\nWe measure the diffusion coefficient using the mean square displacement.",
          "analysisScript": "2d-msd-diffusion.ipynb",
          "imageUrl": "2d-msd-diffusion/2d-msd-diffusion.png",
          "inputScript": "2d-msd-diffusion.in",
          "keywords": [
              "lennard jones",
              "diffusion",
              "mean square displacement"
          ],
          "files": [
              {
                  "fileName": "2d-msd-diffusion.in",
                  "url": "2d-msd-diffusion/2d-msd-diffusion.in"
              },
              {
                "fileName": "2d-msd-diffusion.ipynb",
                "url": "2d-msd-diffusion/2d-msd-diffusion.ipynb"
            }
          ]
      },
      {
        "id": "2d-vacf-diffusion",
        "title": "2D diffusion VACF",
        "description": "We measure the diffusion coefficient using the velocity auto correlation function.",
        "analysisDescription": "# About this simulation\nWe measure the diffusion coefficient using the velocity auto correlation function.",
        "analysisScript": "2d-vacf-diffusion.ipynb",
        "imageUrl": "2d-vacf-diffusion/2d-vacf-diffusion.png",
        "inputScript": "2d-vacf-diffusion.in",
        "keywords": [
            "lennard jones",
            "diffusion",
            "velocity autocorrelation function"
        ],
        "files": [
            {
                "fileName": "2d-vacf-diffusion.in",
                "url": "2d-vacf-diffusion/2d-vacf-diffusion.in"
            },
            {
              "fileName": "2d-vacf-diffusion.ipynb",
              "url": "2d-vacf-diffusion/2d-vacf-diffusion.ipynb"
          }
        ]
    }
  ]
}