How to perform Energy Decompostion Analysis of an open shell system?

Diganta Raychaudhuri @Diganta-Raychaudhuri

09 October 2023 0 9K Report

Want of to perform EDA of an open shell system, Pu(NO3)4.2H2O, here Pu has 4 unpaired electron. Please provide a detailed answer with a procedure of preforming the same in ADF.

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