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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg4-Dec-2019ProductOrtuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-945.015335219; Eh
thumbnail.jpeg4-Dec-2019SilaneOrtuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-560.202592598; Eh
thumbnail.jpeg4-Dec-2019AcetophenoneOrtuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point TSRM062X6-31G** 6-31+G* GEN-384.746857379; Eh
thumbnail.jpeg4-Dec-2019HMPAOrtuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point TSRM062X6-31G** 6-31+G* GEN-820.114235670; Eh
thumbnail.jpeg4-Dec-2019THFOrtuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point TSRM062X6-31G** 6-31+G* GEN-232.354886050; Eh
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-20198TS_(TS8)Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-1804.49846752; Eh
thumbnail.jpeg4-Dec-20193TS_(TS3)Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31G** 6-31+G* GEN-1244.15995673; Eh
thumbnail.jpeg4-Dec-20196TS_(TS6-9)Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point TSRM062X6-31G** 6-31+G* GEN-1244.25955430; 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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