Browsing by Subject Lewis acids

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Showing results 1 to 12 of 12
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg27-Sep-2021KO2m_freqD’Amore, LorenzoADF; Single pointBP86TZP; DZP-
thumbnail.jpeg27-Sep-2021KO2m_tddftD’Amore, LorenzoADF; Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg27-Sep-2021KO2mT_freqD’Amore, LorenzoADF; Single pointBP86TZP; DZP-
thumbnail.jpeg27-Sep-2021LiO2m_freqD’Amore, LorenzoADF; Single pointBP86TZP; DZP-
thumbnail.jpeg27-Sep-2021LiO2m_tddftD’Amore, LorenzoADF; Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg27-Sep-2021LiO2mT_freqD’Amore, LorenzoADF; Single pointBP86TZP; DZP-
thumbnail.jpeg27-Sep-2021NaO2m_freqD’Amore, LorenzoADF; Single pointBP86TZP; DZP-
thumbnail.jpeg27-Sep-2021NaO2m_tddftD’Amore, LorenzoADF; Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg27-Sep-2021NaO2mT_freqD’Amore, LorenzoADF; Single pointBP86TZP; DZP-
thumbnail.jpeg27-Sep-2021O2m_freqD’Amore, LorenzoADF; Single pointBP86TZP; DZP-
thumbnail.jpeg27-Sep-2021O2m_tddftD’Amore, LorenzoADF; Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg27-Sep-2021O2mT_freqD’Amore, LorenzoADF; Single pointBP86TZP; DZP-