Browsing by Author Castro, Abril C.
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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 29-Jun-2023 | /Gold_complexes GreenPhos-13 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -487.578964; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-14 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -477.017872; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-15 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -444.246339; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-16 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -470.756281; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-17 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -477.546431; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-18 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -434.112633; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-19 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -449.073215; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-2 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -335.944413; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-20 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -498.337356; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-3 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -351.031652; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-4 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -356.554308; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-5 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -405.878427; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-6 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -441.393543; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-7 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -369.077814; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-8 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -383.947670; eV | |||
 | 29-Jun-2023 | /Gold_complexes GreenPhos-9 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -416.845222; eV | |||
 | 29-Jun-2023 | /Nickel_complexes GreenPhos-1 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -370.088622; eV | |||
 | 29-Jun-2023 | /Nickel_complexes GreenPhos-10 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -515.165623; eV | |||
 | 29-Jun-2023 | /Nickel_complexes GreenPhos-11 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -459.172989; eV | |||
 | 29-Jun-2023 | /Nickel_complexes GreenPhos-12 | Castro, Abril C. | AMS; 2023.101; r111868 | Frequencies | BP86 | - | -523.730023; eV |