SCF non-additivity of the interaction energy in the neon trimer |
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| Authors: | Marek Bulski |
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| Institution: | 2. Department of Chemistry, University of Bergen, N-5014 Bergen, Norway |
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| Abstract: | The three-body non-additivity of the interaction energy for the equilateral triangle configuration of the Ne3 system has been calculated, using the counterpoise method within the SCF approach. The induction-type non-additivity has been estimated and compared with the first-order exchange one. |
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