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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	30-Jun-2021	/new_complexes Complex_20_H2	Ortuño Maqueda, Manuel Angel	Gaussian; 09; AS64L-G09RevD.01	Geometry optimization Minimum	RM06	SDD 6-31G(D) 6-31+G(D) 6-31G(D,P) GEN	-2417.76011952; Eh
	30-Jun-2021	/new_complexes Complex_20_H	Ortuño Maqueda, Manuel Angel	Gaussian; 09; AS64L-G09RevD.01	Geometry optimization Minimum	RM06	SDD 6-31G(D) 6-31+G(D) 6-31G(D,P) GEN	-2417.40520144; Eh
	30-Jun-2021	/solvent H2O_n=6	Ortuño Maqueda, Manuel Angel	Gaussian; 09; AS64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31G(D,P) 6-31+G(D) GEN	-458.461079467; Eh
	30-Jun-2021	/solvent THF_n=2	Ortuño Maqueda, Manuel Angel	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31G(D,P) 6-31+G(D) 6-31G(D) GEN	-464.598695721; Eh
	30-Jun-2021	/solvent THFH+_n=1	Ortuño Maqueda, Manuel Angel	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31G(D,P) 6-31+G(D) 6-31G(D) GEN	-232.621487672; Eh
	30-Jun-2021	/solvent THF_n=1	Ortuño Maqueda, Manuel Angel	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31G(D,P) 6-31+G(D) 6-31G(D) GEN	-232.295275899; Eh
	30-Jun-2021	/solvent THF_n=3_stacked	Ortuño Maqueda, Manuel Angel	Gaussian; 09; AS64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31G(D,P) 6-31+G(D) 6-31G(D) GEN	-696.901712351; Eh
	30-Jun-2021	/solvent THFH+_n=2	Ortuño Maqueda, Manuel Angel	Gaussian; 09; AS64L-G09RevD.01	Geometry optimization Minimum	RM06	6-31G(D,P) 6-31+G(D) 6-31G(D) GEN	-464.968818287; Eh
	30-Jun-2021	/initial_complexes Complex_4_H2	Ortuño Maqueda, Manuel Angel	Gaussian; 09; AM64L-G09RevC.01	Single point Minimum	RM06	SDD 6-31G(D) 6-31G(D,P) GEN	-1968.07177083; Eh
	30-Jun-2021	/initial_complexes Complex_3_H	Ortuño Maqueda, Manuel Angel	Gaussian; 09; AM64L-G09RevC.01	Single point Structure	RM06	SDD 6-31G(D) 6-31G(D,P) GEN	-1771.22460343; Eh

Results 21-30 of 65 (Search time: 0.001 seconds).