Molecular modelling of metal copolymer complexes using DFT method, is it possible ?

21 August 2022 0 5K Report

I seek for for the method elaborated to use Material studio software 8 to study the geometry optimization and other different energy functions for the metal complexes of co-polymer.

if it possible to utilize material studio software for co-polymer compounds, what are suggested steps and the basis sets we can follow to do that ?

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