NNP_Cu_O
Collection home page
Share - copy and redistribute the material in any medium or format. Adapt - remix, transform, and build upon the material for any purpose, even commercially. The licensor cannot revoke these freedoms as long as you follow the license terms.
Please use this identifier to cite or link to this collection:
DOI: 10.19061/iochem-bd-6-228
This dataset derived results are published in:
Manuscript title: Stability and lifetime of diffusion-trapped oxygen in oxide-derived copper CO2 reduction electrocatalysts
Journal: Nature Catalysis
DOI: 10.1038/s41929-024-01132-5
Collection's Items (Sorted by Submit Date in Descending order): 381 to 400 of 6322
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/8ns 13 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/8ns 18 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/8ns 23 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/8ns 28 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/8ns 33 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/8ns 38 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/8ns 43 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/8ns 48 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/4ns 03 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/4ns 08 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/4ns 13 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/4ns 18 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/4ns 23 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/4ns 28 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/4ns 33 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/4ns 38 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/4ns 43 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/4ns 48 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/2ns 03 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
 | 6-Nov-2023 | /NNP_application/annealing_convergence_test/time_at_high_temperature/2ns 08 | Lian, Zan | LAMMPS; 29 Sep 2021 - Update 3 | Molecular Dynamics | - | - | - | | | |
Collection's Items (Sorted by Submit Date in Descending order): 381 to 400 of 6322
