The exact energy of a ground-state He atom is 79.01 eV. Calculate the correlation energy and the

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The exact energy of a ground-state He atom is €“79.01 eV. Calculate the correlation energy and the ratio of the correlation energy to the total energy for He using the results in Table 21.1.

TABLE 21.1 Total Energy and 1s Orbital Energy for He for Three Different Basis Sets Used to Represent the 15 Orbital Num

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Physical Chemistry

ISBN: 978-0321812001

3rd edition

Authors: Thomas Engel, Philip Reid

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Question Posted: May 17, 2018 03:34 AM

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The exact energy of a ground-state He atom is 79.01 eV. Calculate the correlation energy and the

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Physical Chemistry

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