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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	15-Nov-2023	/Cluster_M06 MeOH	Le, Hiep	Gaussian; 16; ES64L-G16RevC.01	Single point Minimum	RM06	DEF2SVP GEN	-115.560951605; Eh
	1-Sep-2023	Constrained_optimisation_of_RS7	Novotny, Jan	Gaussian; 09; ES64L-G09RevE.01	Geometry optimization Structure	RM06	GEN	-645.837029895; Eh
	1-Sep-2023	EDA-NOCV	Novotny, Jan	Gaussian; 09; ES64L-G09RevE.01	Geometry optimization Structure	RM06	GEN	-645.837029895; Eh
	1-Sep-2023	Constrained_optimisation_of_RS8	Novotny, Jan	Gaussian; 09; ES64L-G09RevE.01	Geometry optimization Structure	RM06	GEN	-645.837029895; Eh
	14-Sep-2023	/Scaling_factors NH3_(opt-freq)_-_M06_6-311++G(2d,2p)_No_solvation	Nicolaou, Michael	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RM06	6-311++G(2D,2P)	-56.5414207531; Eh
	14-Sep-2023	/Scaling_factors H2CO_(opt-freq)_-_M06_6-311++G(2d,2p)_No_solvation	Nicolaou, Michael	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RM06	6-311++G(2D,2P)	-114.474446505; Eh
	14-Sep-2023	/Scaling_factors H2O_(opt-freq)_-_M06_6-311++G(2d,2p)_No_solvation	Nicolaou, Michael	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RM06	6-311++G(2D,2P)	-76.4218852220; Eh
	14-Sep-2023	/Scaling_factors N2O_(opt-freq)_-_M06_6-311++G(2d,2p)_No_solvation	Nicolaou, Michael	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RM06	6-311++G(2D,2P)	-184.627230412; Eh
	14-Sep-2023	/Scaling_factors CO2_(opt-freq)_-_M06_6-311++G(2d,2p)_No_solvation	Nicolaou, Michael	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RM06	6-311++G(2D,2P)	-188.563037817; Eh
	14-Sep-2023	/Scaling_factors HCN_(opt-freq)_-_M06_6-311++G(2d,2p)_No_solvation	Nicolaou, Michael	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RM06	6-311++G(2D,2P)	-93.3880951774; Eh

Results 521-530 of 540 (Search time: 0.002 seconds).