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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_Acetonitrile_TZP_no | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -459.897953; 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 | alpha-_SiW12O40__4-_BP86_Water_TZP_TMA | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -793.065028; eV | |||
 | 30-Oct-2023 | alpha-_SiW12O40__4-_BP86_Water_TZP_Li | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -456.611998; eV | |||
 | 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-_PW12O40__3-_BP86_Water_TZP_TBA | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -1286.875473; eV | |||
 | 30-Oct-2023 | alpha-_PW12O40__3-_BP86_Water_TZP_TMA | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -703.711375; eV | |||
 | 30-Oct-2023 | alpha-_PW12O40__3-_BP86_Acetonitrile_TZP_Li | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -450.911162; eV | |||
 | 30-Oct-2023 | alpha-_PW12O40__3-_BP86_Water_TZP_Li | Jacobs, Jake | AMS; 2021.106; r99350 | Geometry optimization | BP86 | - | -451.170047; eV |
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