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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg23-Oct-2019PdPh1Petter, DunåsGaussian; 16; ES64L-G16RevB.01Single point StructureRB3LYPGEN-
thumbnail.jpeg23-Oct-201910Petter, DunåsGaussian; 16; ES64L-G16RevB.01Single point StructureRB3LYPGEN-
thumbnail.jpeg23-Oct-2019TS8_cis_outPetter, DunåsGaussian; 16; ES64L-G16RevB.01Single point StructureRB3LYPGEN-
thumbnail.jpeg23-Oct-2019TS1_cis_inPetter, DunåsGaussian; 16; ES64L-G16RevB.01Single point StructureRB3LYPGEN-
thumbnail.jpeg23-Oct-2019TS6_cis_inPetter, DunåsGaussian; 16; ES64L-G16RevB.01Single point StructureRB3LYPGEN-
thumbnail.jpeg23-Oct-2019TS6_trans_outPetter, DunåsGaussian; 16; ES64L-G16RevB.01Single point StructureRB3LYPGEN-
thumbnail.jpeg23-Oct-2019TS5_trans_inPetter, DunåsGaussian; 16; ES64L-G16RevB.01Single point StructureRB3LYPGEN-
thumbnail.jpeg23-Oct-2019IN1Petter, DunåsGaussian; 16; ES64L-G16RevB.01Single point StructureRB3LYPGEN-
thumbnail.jpeg23-Oct-2019IN2Petter, DunåsGaussian; 16; ES64L-G16RevB.01Single point StructureRB3LYPGEN-
thumbnail.jpeg23-Oct-2019IN3_isoPetter, DunåsGaussian; 16; ES64L-G16RevB.01Single point StructureRB3LYPGEN-
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