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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 6-Aug-2020 | /freq/intermediates/Ag/I top | Pablo-García, Sergio | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Frequencies | DFT | - | -102.52620455; eV | |||
 | 6-Aug-2020 | /freq/intermediates/Ag/I hcp | Pablo-García, Sergio | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Frequencies | DFT | - | -103.04413541; eV | |||
 | 6-Aug-2020 | /freq/intermediates/Ag/I fcc | Pablo-García, Sergio | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Frequencies | DFT | - | -103.06256785; eV | |||
 | 6-Aug-2020 | /freq/intermediates/Ag/F top | Pablo-García, Sergio | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Frequencies | DFT | - | -103.61229329; eV | |||
 | 6-Aug-2020 | /freq/intermediates/Ag/F hcp | Pablo-García, Sergio | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Frequencies | DFT | - | -104.06967521; eV | |||
 | 6-Aug-2020 | /freq/intermediates/Ag/F fcc | Pablo-García, Sergio | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Frequencies | DFT | - | -104.13317020; eV | |||
 | 6-Aug-2020 | /freq/intermediates/Ag/Cl top | Pablo-García, Sergio | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Frequencies | DFT | - | -102.88941694; eV | |||
 | 6-Aug-2020 | /freq/intermediates/Ag/Cl hcp | Pablo-García, Sergio | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Frequencies | DFT | - | -103.36799447; eV | |||
 | 6-Aug-2020 | /freq/intermediates/Ag/Cl fcc | Pablo-García, Sergio | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Frequencies | DFT | - | -103.41016128; eV | |||
 | 6-Aug-2020 | /freq/intermediates/Ag/CI top | Pablo-García, Sergio | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Frequencies | DFT | - | -107.05756339; eV |
Results 31-40 of 254 (Search time: 0.001 seconds).