On the suitability of strictly localized orbitals for hybrid QM/MM calculations

Arianna Fornili, Yohann Moreau, Maurizio Sironi, Xavier Assfeld. On the suitability of strictly localized orbitals for hybrid QM/MM calculations. Journal of Computational Chemistry, 27(4):515-523, 2006. [doi]

Authors

Arianna Fornili

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Yohann Moreau

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Maurizio Sironi

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Xavier Assfeld

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