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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-May-2018/Suggested_Synthesis_Theosilane T2_without_NMe3Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X--1209.16081017; Eh
thumbnail.jpeg22-May-2018/Suggested_Synthesis_Theosilane I4Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X--1453.51390419; Eh
thumbnail.jpeg22-May-2018/Suggested_Synthesis_Theosilane I3Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X--1209.32696902; Eh
thumbnail.jpeg22-May-2018/Suggested_Synthesis_Theosilane T5Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X--1453.51277924; Eh
thumbnail.jpeg22-May-2018/Suggested_Synthesis_Theosilane TheosilaneFianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X--750.880122136; Eh
thumbnail.jpeg22-May-2018/Suggested_Synthesis_Theosilane I5Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X--749.656476781; Eh
thumbnail.jpeg22-May-2018/Suggested_Synthesis_Theosilane AlH3Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X--244.168886795; Eh
thumbnail.jpeg22-May-2018/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T1_H2SiPh2_Mech3Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X--1559.42610913; Eh
thumbnail.jpeg22-May-2018/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T2_H2SiPh2_Mech2Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X--1559.42689616; Eh
thumbnail.jpeg22-May-2018/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T1_H2SiPh2_Mech1Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X--1559.43337015; Eh
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