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Item hits:
| Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
|---|---|---|---|---|---|---|---|---|
 | 1 | Solé-Daura, Albert | Gaussian; 16; ES64L-G16RevC.01 | RwB97XD | LANL2DZ 6-31G(D,P) GENECP | -1831.94098188; Eh | ||
 | 2 | Solé-Daura, Albert | Gaussian; 16; ES64L-G16RevC.01 | UwB97XD | LANL2DZ 6-31G(D,P) GENECP | -1832.06883329; Eh |
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