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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	7-May-2024	c5ab-enea	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	GEN	-1391.14251439; Eh
	7-May-2024	c5ab-enec	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	GEN	-1391.14780727; Eh
	7-May-2024	c3ab	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	GEN	-1084.75584644; Eh
	7-May-2024	c5ab	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	GEN	-1084.74147110; Eh
	7-May-2024	c5ab-cmdb	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	SDD 6-31G(D,P) GEN	-1742.75949140; Eh
	7-May-2024	c5ab-cmda	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	GEN	-1742.76709570; Eh
	7-May-2024	c3ab-cmdb	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	GEN	-1742.76504944; Eh
	11-Apr-2024	CargillTSaConf1AlMe2Cl_log	Tantillo, Dean	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1637.80947238; Eh
	11-Apr-2024	CargillTSaConf0AlMe2Cl_log	Tantillo, Dean	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1637.80947238; Eh
	11-Apr-2024	CargillTSaConf2AlMe2Cl_log	Tantillo, Dean	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1637.80643574; Eh

Results 1351-1360 of 1449 (Search time: 0.002 seconds).