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Item hits:
Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
---|---|---|---|---|---|---|---|---|
FigureA1_nano_id90_050_relax_-761_991 | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:39:51) gamma-only | DFT | - | -761.99059395; eV | |||
FigureA1_nano_id92_054_relax_-760_323 | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:39:51) gamma-only | DFT | - | -760.32321295; eV | |||
FigureA1_nano_id95_055_relax_-758_341 | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:39:51) gamma-only | DFT | - | -758.34092308; eV | |||
FigureA1_nano_id93_018_relax_-755_776 | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:39:51) gamma-only | DFT | - | -755.77585137; eV | |||
FigureA1_nano_id94_020_relax_-759_62 | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:39:51) gamma-only | DFT | - | -759.61958761; eV |
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