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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 22-Mar-2020 | /M062X_BS1_optimized_structures m062_pha_prod1f | G. Algarra, Andrés | Gaussian; 09; ES64L-G09RevD.01 | Single point Structure | RM062X | 6-31G(D,P) SDDALL GEN | -2741.22989676; Eh | |||
 | 22-Mar-2020 | /M06HF_BS1_optimized_structures hfga_m06_dmadprodrf | G. Algarra, Andrés | Gaussian; 09; ES64L-G09RevD.01 | Single point Structure | RM06HF | 6-31G(D,P) SDDALL GEN | -2965.76681385; Eh | |||
 | 22-Mar-2020 | /PBE1PBE-D3(0)_BS1_optimized_structures d3p0_clusteracacpy | G. Algarra, Andrés | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | RPBE1PBE | 6-31G(D,P) SDDALL GEN | -2024.33855513; Eh |
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