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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg4-Dec-20197TS_(TS7-8)Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-1804.50263203; Eh
thumbnail.jpeg4-Dec-20192_LDA_monomerOrtuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-763.984114124; Eh
thumbnail.jpeg4-Dec-2019LiAQ-2Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-1883.85996572; Eh
thumbnail.jpeg4-Dec-2019LiAQ-4Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-2471.62697884; Eh
thumbnail.jpeg4-Dec-2019LiAQ-3Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-2143.77962771; Eh
thumbnail.jpeg4-Dec-20198Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-1804.51745090; Eh
thumbnail.jpeg4-Dec-2019ProductOrtuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-945.015335219; Eh
thumbnail.jpeg4-Dec-20195Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-1244.23780169; Eh
thumbnail.jpeg4-Dec-20195TS_(TS5-6)Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-1244.22858649; Eh
thumbnail.jpeg4-Dec-20199TS_(TS9)Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-1244.25420623; Eh
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