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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg18-Nov-2023/au A2Bro-Jørgensen, WilliamSiesta; 5.0.0-alpha-76-gf0a1dd915-dirtyGeometry optimizationGGAPBE-----
thumbnail.jpeg18-Nov-2023/au B2Bro-Jørgensen, WilliamSiesta; 5.0.0-alpha-76-gf0a1dd915-dirtyGeometry optimizationGGAPBE-----
thumbnail.jpeg18-Nov-2023/gas_phase D4Bro-Jørgensen, WilliamSiesta; 5.0.0-alpha-76-gf0a1dd915Geometry optimizationGGAPBE-----
thumbnail.jpeg18-Nov-2023/au A3Bro-Jørgensen, WilliamSiesta; 5.0.0-alpha-76-gf0a1dd915-dirtyGeometry optimizationGGAPBE-----
thumbnail.jpeg18-Nov-2023/gas_phase A3Bro-Jørgensen, WilliamSiesta; 5.0.0-alpha-76-gf0a1dd915Geometry optimizationGGAPBE-----
thumbnail.jpeg18-Nov-2023/au B4Bro-Jørgensen, WilliamSiesta; 5.0.0-alpha-76-gf0a1dd915-dirtyGeometry optimizationGGAPBE-----
thumbnail.jpeg18-Nov-2023/gas_phase C2Bro-Jørgensen, WilliamSiesta; 5.0.0-alpha-76-gf0a1dd915Geometry optimizationGGAPBE-----
thumbnail.jpeg18-Nov-2023/au A4-HBro-Jørgensen, WilliamSiesta; 5.0.0-alpha-76-gf0a1dd915-dirtyGeometry optimizationGGAPBE-----
thumbnail.jpeg18-Nov-2023/au C2Bro-Jørgensen, WilliamSiesta; 5.0.0-alpha-76-gf0a1dd915-dirtyGeometry optimizationGGAPBE-----
thumbnail.jpeg18-Nov-2023/gas_phase A1Bro-Jørgensen, WilliamSiesta; 5.0.0-alpha-76-gf0a1dd915Geometry optimizationGGAPBE-----
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