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About an incoherent precision behavior in LCAO MO theory when a simple diatomic molecule collapses into an atom

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References

  1. R.G. Parr, The Quantum Theory of Molecular Electronic Structure (W. A. Benjamin, Inc., New York, 1963)

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  2. E. Clementi, C. Roetti, Atomic Data and Nuclear Data Tables, Roothaan–Hartree–Fock Atomic Wavefunctions, 14th edn. (Academic Press, New York, 1974), pp. 177–478

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  3. R. Carbó-Dorca, J. Math. Chem. 53, 590–603 (2015)

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The author states that there is no conflict of interest, concerning the contents of the present letter.

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Authors and Affiliations

  1. Secciò de Química Quàntica i Matemàtica, Centre Europeu de Recerca Teòrica, Universitat de Girona, 17071, Girona, Catalonia, Spain

    Ramon Carbó-Dorca

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  1. Ramon Carbó-Dorca
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Correspondence to Ramon Carbó-Dorca.

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Carbó-Dorca, R. About an incoherent precision behavior in LCAO MO theory when a simple diatomic molecule collapses into an atom. J Math Chem 54, 845–848 (2016). https://doi.org/10.1007/s10910-016-0607-x

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  • DOI: https://doi.org/10.1007/s10910-016-0607-x

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