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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	22-May-2018	/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T5_H2SiPh2	Fianchini, Mauro	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RM062X	-	-1634.74653143; Eh
	22-May-2018	/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T4_H2SiPh2	Fianchini, Mauro	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RM062X	-	-1634.73214471; Eh
	22-May-2018	/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T3_H2SiPh2	Fianchini, Mauro	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RM062X	-	-1559.42531139; Eh
	22-May-2018	/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T2_H2SiPh2	Fianchini, Mauro	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RM062X	-	-1559.44557558; Eh
	8-May-2017	Pt-8-07	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Improved Dimer Method	-	-	-319.20695926; eV
	8-May-2017	Pd-3-20	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-286.26284061; eV
	8-May-2017	Ru-3-08	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Improved Dimer Method	-	-	-363.53876574; eV
	8-May-2017	Pt-2511	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complex	Geometry optimization	-	-	-325.82318149; eV
	23-Jul-2018	/cis2butene/Ni/111/1H C4H8toC4H9NT	Navarro-Ruiz, Javier; Cornu, Damien	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	DFT	-	-303.51337320; eV
	22-May-2018	/1-phenylphospholane_oxide_+_H2SiPh2_in_toluene/Dioxane_373K T1_H2SiPh2_Mech3	Fianchini, Mauro	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RM062X	-	-1559.42610913; Eh

Results 10881-10890 of 104079 (Search time: 0.008 seconds).