Question: Python or Matlab expert Code is required to calculate the enthalpy for polyatomic perovskites such as NH3CH3PdBr3 To know is it has a negative or

Python or Matlab expert

Code is required to calculate the enthalpy for polyatomic perovskites such as NH3CH3PdBr3

To know is it has a negative or positive value

In crystal structures, the Murnghan equation of state is used and that's the iteration process. Similarly in Gussain or other software similar approach is used.

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