1. Barcelona Supercomputing Center

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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg8-Nov-2023/NNP_application/Odiffusion/Cu_shell/remove_different_layers/10layers 6Lian, ZanLAMMPS; 29 Sep 2021 - Update 3Molecular Dynamics---
thumbnail.jpeg8-Nov-2023/NNP_application/Odiffusion/Cu_shell/remove_different_layers/10layers 7Lian, ZanLAMMPS; 29 Sep 2021 - Update 3Molecular Dynamics---
thumbnail.jpeg8-Nov-2023/NNP_application/Odiffusion/Cu_shell/remove_different_layers/10layers 8Lian, ZanLAMMPS; 29 Sep 2021 - Update 3Molecular Dynamics---
thumbnail.jpeg8-Nov-2023/NNP_application/Odiffusion/Cu_shell/remove_different_layers/12layers 9Lian, ZanLAMMPS; 29 Sep 2021 - Update 3Molecular Dynamics---
thumbnail.jpeg8-Nov-2023/NNP_application/Odiffusion/Cu_shell/remove_different_layers/14layers 1Lian, ZanLAMMPS; 29 Sep 2021 - Update 3Molecular Dynamics---
thumbnail.jpeg8-Nov-2023/NNP_application/Odiffusion/Cu_shell/remove_different_layers/14layers 10Lian, ZanLAMMPS; 29 Sep 2021 - Update 3Molecular Dynamics---
thumbnail.jpeg8-Nov-2023/NNP_application/Odiffusion/Cu_shell/remove_different_layers/14layers 4Lian, ZanLAMMPS; 29 Sep 2021 - Update 3Molecular Dynamics---
thumbnail.jpeg8-Nov-2023/NNP_application/Odiffusion/Cu_shell/remove_different_layers/14layers 3Lian, ZanLAMMPS; 29 Sep 2021 - Update 3Molecular Dynamics---
thumbnail.jpeg8-Nov-2023/NNP_application/Odiffusion/Cu_shell/remove_different_layers/12layers 8Lian, ZanLAMMPS; 29 Sep 2021 - Update 3Molecular Dynamics---
thumbnail.jpeg8-Nov-2023/NNP_application/Odiffusion/Cu_shell/remove_different_layers/14layers 2Lian, ZanLAMMPS; 29 Sep 2021 - Update 3Molecular Dynamics---
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