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Relativistic correction to the helium dimer interaction energy

The lowest-order relativistic correction to the helium-helium interaction energy has been calculated for the first time, using two independent methods based on expansions in explicitly correlated Gaussian functions. At the equilibrium interatomic distance of 5.6 bohr, this correction amounts to +15....

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Bibliographic Details
Published in:Physical review letters 2005-12, Vol.95 (23), p.233004.1-233004.4, Article 233004
Main Authors: CENCEK, Wojciech, KOMASA, Jacek, PACHUCKI, Krzysztof, SZALEWICZ, Krzysztof
Format: Article
Language:English
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Summary:The lowest-order relativistic correction to the helium-helium interaction energy has been calculated for the first time, using two independent methods based on expansions in explicitly correlated Gaussian functions. At the equilibrium interatomic distance of 5.6 bohr, this correction amounts to +15.4 +/- 0.6 mK. As a by-product, a new upper bound of -10.9985 K for the nonrelativistic Born-Oppenheimer interaction energy has been obtained.
ISSN:0031-9007
1079-7114
DOI:10.1103/physrevlett.95.233004