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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/FreeCopes/TS_3t__3t MM2-72-cisCHD-to-CHDCHD-TSopt | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Rh/FreeCopes/3t MM2-73-cisCHD-to-CHDCHD-TS-TS-less | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Rh/FreeCopes/3x_ MM2-20-cisCOD-to-CHDCOD-TSdef--more | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Rh/IV__trans MM3-17-trans-proximal-TS-MORE | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Ch F-TSXIVa-XVa | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Ch TSXIIIb-XIVb | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Ch TSXIIIa-XVIa | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Ch TSXIVb-XVIb | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Ch XIIIb | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - | |||
 | 16-Oct-2020 | /Au_Ch XVIa | Armengol i Relats, Helena | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | - |
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