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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 30-Oct-2023 | alpha-_SiW12O40__4-_BP86_Water_TZP_no | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -456.611998; eV | |||
 | 30-Oct-2023 | alpha-_SiW12O40__4-_BP86_no_TZP_Li | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -455.100665; eV | |||
 | 30-Oct-2023 | alpha-_SiW12O40__4-_BP86_no_TZP_no | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -441.792855; eV | |||
 | 30-Oct-2023 | gamma-_SiW12O40__4-_BP86_Acetonitrile_TZP_no | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -458.961498; eV | |||
 | 30-Oct-2023 | gamma-_SiW12O40__4-_BP86_Water_TZP_no | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -459.321307; eV | |||
 | 30-Oct-2023 | _W10O32__4-_BP86_Acetonitrile_TZP_no | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -367.879638; eV | |||
 | 30-Oct-2023 | _W10O32__4-_BP86_Water_TZP_no | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -368.246473; eV | |||
 | 30-Oct-2023 | _W10O32__4-_BP86_no_TZP_no | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -348.669294; eV | |||
 | 30-Oct-2023 | beta_-_W18O56(IO6)__9-_BP86_Acetonitrile_TZP_no | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -687.333020; eV | |||
 | 30-Oct-2023 | beta_-_W18O56(IO6)__9-_BP86_Water_TZP_no | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -688.673845; eV |
Results 111-120 of 141 (Search time: 0.001 seconds).