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PreviewTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetLinksEnergySolv.Vibr.Orb.
thumbnail.jpeg000297065 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---570.781300986; Eh
thumbnail.jpegL1Ortuño, Manuelvasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-onlyGeometry optimization----154.03181633; eV
thumbnail.jpeg000247356 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---570.767146684; Eh
thumbnail.jpeg000225557 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---570.740154686; Eh
thumbnail.jpeg000193288 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---570.816557410; Eh
thumbnail.jpeg000192719 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---570.815418891; Eh
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