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General Questions and Answers / Re: zero point energy
« on: October 15, 2020, 11:28 »
You can distinguish the H2 and D2(see the H in the periodic table) when you build the molecules. You will need to perform the vibration modes of the atoms. You can add the VibrationalMode in the analysis. https://docs.quantumatk.com/manual/Types/VibrationalMode/VibrationalMode.html