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Orthogonal Valence Bond as a Bridge Between the Valence Bond and Molecular Orbital Representations of the Wave Function
Angeli, Celestino; Guihéry, Nathalie; Malrieu, Jean-Paul
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Elsevier,
Comprehensive Computational Chemistry
Vol. 1, No. 1, pp: 454-480, Anno: 2024 |
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Common Format for Quantum Chemistry Interoperability: Q5Cost Format and Library
A., Scemama; A., Monari; Angeli, Celestino; S., Borini; S., Evangelisti; E., Rossi
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Springer,
Computational Science and Its Applications – ICCSA 2008
pp: 1094-1107, Anno: 2008 |
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