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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg17-Jan-2025/nep/1e-9 run_22Bro-Jørgensen, WilliamLAMMPS; 28 Mar 2023 - DevelopmentGeometry optimization---
thumbnail.jpeg17-Jan-2025/nep/1e-8 run_1Bro-Jørgensen, WilliamLAMMPS; 28 Mar 2023 - DevelopmentMolecular Dynamics---
thumbnail.jpeg17-Jan-2025/nep/1e-6 run_1Bro-Jørgensen, WilliamLAMMPS; 28 Mar 2023 - DevelopmentMolecular Dynamics---
thumbnail.jpeg17-Jan-2025/nep/1e-5 run_1Bro-Jørgensen, WilliamLAMMPS; 28 Mar 2023 - DevelopmentMolecular Dynamics---
thumbnail.jpeg16-Jan-2025/reaxff/1e-5 run_1Bro-Jørgensen, WilliamLAMMPS; 28 Mar 2023 - DevelopmentMolecular Dynamics---
thumbnail.jpeg16-Jan-2025/reaxff/1e-6 run_1Bro-Jørgensen, WilliamLAMMPS; 28 Mar 2023 - DevelopmentMolecular Dynamics---
thumbnail.jpeg17-Jan-2025/nep/1e-7 run_90Bro-Jørgensen, WilliamLAMMPS; 28 Mar 2023 - DevelopmentMolecular Dynamics---
thumbnail.jpeg16-Jan-2025/eam/1e-5 run_1Bro-Jørgensen, WilliamLAMMPS; 28 Mar 2023 - DevelopmentMolecular Dynamics---
thumbnail.jpeg16-Jan-2025/eam/1e-6 run_1Bro-Jørgensen, WilliamLAMMPS; 28 Mar 2023 - DevelopmentMolecular Dynamics---
Results 1-9 of 9 (Search time: 0.001 seconds).