Search
Add filters:
Use filters to refine the search results.
Item hits:
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 29-Aug-2017 | /Solvated_Calculations TS_diss_charge_0 | Rellán, Marcos | vasp; 5.3.3; 18Dez12 (build Aug 29 2016 09:59:29) complex | N/A | - | - | -547.59925486; eV | |||
 | 10-May-2017 | H3COH_(solvated) | Garcia-Ratés, Miquel | vasp; 5.3.3; 18Dez12 (build Aug 29 2016 09:59:29) complex | N/A | - | - | -30.45668531; eV | |||
 | 26-Mar-2018 | C1a | Ortuño, Manuel | vasp; 5.3.5; 31Mar14 (build May 25 2015 11:37:25) complex | N/A | N/A | - | -981.33000607; eV | |||
 | 26-Mar-2018 | C1 | Ortuño, Manuel | vasp; 5.3.5; 31Mar14 (build May 25 2015 11:37:25) complex | N/A | N/A | - | -981.56532956; eV | |||
 | 26-Mar-2018 | C1b | Ortuño, Manuel | vasp; 5.3.5; 31Mar14 (build May 25 2015 11:37:25) complex | N/A | N/A | - | -981.36401850; eV | |||
 | 17-Oct-2017 | /Solvation/h2o G1 | Li, Qiang | vasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complex | N/A | - | - | -154.39093738; eV | |||
 | 17-Oct-2017 | /Solvation/h2o G6 | Li, Qiang | vasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complex | N/A | - | - | -162.53974271; eV | |||
 | 17-Oct-2017 | /Solvation/h2o G8 | Li, Qiang | vasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complex | N/A | - | - | -169.25300607; eV | |||
 | 17-Oct-2017 | /Solvation/h2o G5 | Li, Qiang | vasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complex | N/A | - | - | -169.50396606; eV | |||
 | 17-Oct-2017 | /Solvation/h2o G9 | Li, Qiang | vasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complex | N/A | - | - | -162.83798140; eV |
Results 11-20 of 231 (Search time: 0.001 seconds).
Discover
Subject
- 58 3D Perovskites
- 58 Lead free