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Eugene S. Kryachko Modeling molecular interactions by analytic potentials: Analytic perturbation treatment International Journal of Quantum Chemistry 112

Version of Record online: 7 MAY 2012 | DOI: 10.1002/qua.24136

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The concept of molecular potential is a key in the study of molecular interactions. This article focuses on the class of so-called “spiked potentials,” obtained by a combination of the harmonic oscillator and a singular potential. Spiked potentials were believed to be impossible to treat perturbatively. This work analytically demonstrates the contrary: the perturbation theory is definitely applicable to the spiked potentials.

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