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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	7-Jan-2023	/ACN-M06-2X_6-311g(d,p) DHI-Me_S0_Min	Blancafort, Lluís	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RM062X	6-311G(D,P)	-1325.20473245; Eh
	7-Jan-2023	/ACN-M06-2X_6-311g(d,p) IQ-Me_S0_Min	Blancafort, Lluís	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RM062X	6-311G(D,P)	-1323.95248295; Eh
	7-Jan-2023	/ACN-PBE_6-311g(d,p) SQ-Me_(5-OH)	Blancafort, Lluís	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	UPBE1PBE	6-311G(D,P)	-1323.56238728; Eh
	14-Feb-2023	Optimization_H_complex_l132	Escayola, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RBLYP	LANL2DZ DEF2TZVP GEN	-2435.14781593; Eh
	14-Feb-2023	Optimization_H_complex_l95	Escayola, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RBLYP	LANL2DZ DEF2TZVP GEN	-2356.51104972; Eh
	12-Dec-2022	SC5OMeB_RNaphth	Lledó, Agustí	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	-	ZDO	-0.585157536596; Eh
	12-Dec-2022	SC5OMeB_ScPr	Lledó, Agustí	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	-	ZDO	-0.623107508040; Eh
	12-Dec-2022	SC5OMeB_4CHCl3	Lledó, Agustí	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	-	ZDO	-0.955296873082; Eh
	10-May-2023	D-C6F5Br	Iglesias-Reguant, Alex	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization Minimum	RMN15	AUG-CC-PVDZ GEN	-2464.66539231; Eh
	10-May-2023	D-C6F5Cl	Iglesias-Reguant, Alex	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization Minimum	RMN15	AUG-CC-PVDZ GEN	-2507.49116240; Eh

Results 1021-1030 of 1202 (Search time: 0.001 seconds).