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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	9-Feb-2023	/H 1b	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RM062X	6-31G(D,P)	-1674.37997476; Eh
	9-Feb-2023	/model I	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RM062X	6-31G(D,P)	-1218.78306007; Eh
	9-Feb-2023	/model TS2	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RM062X	6-31G(D,P)	-1218.74359639; Eh
	9-Feb-2023	/enamine TS2c_toluene_	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RM062X	6-31G(D,P)	-1885.66743411; Eh
	9-Feb-2023	/enamine TS3c_toluene	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RM062X	6-31G(D,P)	-1885.67133388; Eh
	9-Feb-2023	/enamine TS3c_DCM	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RM062X	6-31G(D,P)	-1885.67808734; Eh
	9-Feb-2023	/Hammett TS_CO2Me	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RM062X	6-31G(D,P)	-2133.12314095; Eh
	9-Feb-2023	/Hammett TS_Cl	Guo, Wentao	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RM062X	6-31G(D,P)	-2364.89318373; Eh
	9-Feb-2023	/Hammett TS_CN	Guo, Wentao	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RM062X	6-31G(D,P)	-1997.54010191; Eh
	9-Feb-2023	/Hammett TS_F	Guo, Wentao	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RM062X	6-31G(D,P)	-2004.52600369; Eh

Results 51-60 of 113 (Search time: 0.002 seconds).