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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 16-Oct-2020 | /Rh/Vb MM3-11-transcyclopropanation-CHD-TSopt-LESS | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Rh/VII MM3-33-cisdistal-to-CHDprod-MORE | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Cp 6a-Au-alkyne | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Cp 6a-Au-alkene | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Cp TSXa-XIIa | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Cp TSXb-XIb | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Cp XIIb | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Cp XIIa | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Cp 6a | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Cp IXb | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - |
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