Search        

Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-May-2018/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T5_H2SiPh2Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X--1634.74653143; Eh
thumbnail.jpeg22-May-2018/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T4_H2SiPh2Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X--1634.73214471; Eh
thumbnail.jpeg22-May-2018/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T3_H2SiPh2Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X--1559.42531139; Eh
thumbnail.jpeg22-May-2018/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T2_H2SiPh2Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X--1559.44557558; 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 T0_H2SiPh2Fianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X--1559.43497940; Eh
thumbnail.jpeg24-Feb-2020/SupportingStructures/Benchmark/wb97xd TS2NWPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRwB97XD6-31+G(D,P)-849.441885929; 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
thumbnail.jpeg22-May-2018/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K PhenylphospholaneFianchini, MauroGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X--730.208978175; Eh
Results 1671-1680 of 12842 (Search time: 0.004 seconds).