I am looking to predict properties like the Bulk Modulus, total energy, etc., all from the charge density I have as input (CHGCAR file)

  • 1
    $\begingroup$ How could you predict bulk modulus from electronic charge density? $\endgroup$
    – Camps
    Oct 25, 2023 at 0:26
  • $\begingroup$ Birch Murugan EOS $\endgroup$
    – Pranoy Ray
    Oct 25, 2023 at 14:35
  • 2
    $\begingroup$ This is a very vague, potentially incorrect question. You should be more specific what kind of methods you are looking for. $\endgroup$
    – Greg
    Oct 26, 2023 at 14:54


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