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A routine to compute the energy and wave function for one-electron two-nuclei molecular systems - MaRDI portal

A routine to compute the energy and wave function for one-electron two-nuclei molecular systems

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Publication:1301542

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DOI10.1016/S0010-4655(97)00058-1zbMath0940.81050OpenAlexW1999725961MaRDI QIDQ1301542

Fabio Sattin

Publication date: 25 July 2000

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/s0010-4655(97)00058-1

zbMATH Keywords

wave function diatomic molecule molecular physics eigen energy one-electron

Mathematics Subject Classification ID

Computational methods for problems pertaining to quantum theory (81-08) Molecular physics (81V55)

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