[DFTB-Plus-User] Dipole moment for periodic and non periodic systems

[Ariadni BOZIKI]

Dear all,

After reviewing both the source code and the mailing list discussions, I am uncertain whether the dipole moment calculation method remains the same for both periodic and non-periodic systems in DFTB+. I am particularly interested in knowing if a different algorithm is employed for computing the dipole moment of a crystal in the context of periodic systems. If such differentiation exists, could you kindly provide insight into the specific method utilized?

Thank you in advance.

With all best wishes,

Ariadni
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