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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 14-Nov-2023 | IM6_postts5a_cb3_fcont_r_irc_calcfc_ms50_freq | DeSnoo, William | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RPBE1PBE | DEF2SVP | -5399.57984028; Eh | |||
 | 14-Nov-2023 | P3_product_5a_freq | DeSnoo, William | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RPBE1PBE | DEF2SVP | -695.424765784; Eh | |||
 | 14-Nov-2023 | P2_product_4a_freq | DeSnoo, William | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RPBE1PBE | DEF2SVP | -695.434776284; Eh | |||
 | 14-Nov-2023 | P1_product_3a_freq | DeSnoo, William | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RPBE1PBE | DEF2SVP | -695.442811517; Eh | |||
 | 14-Nov-2023 | IM1 | DeSnoo, William | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RPBE1PBE | DEF2SVP | -1892.06357842; Eh |
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