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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	10-Aug-2020	Fe_nnHS-PCo4-Eo-b3lyp-ls-pcmb-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	UB3LYP	LANL2DZ 6-31G(D) 6-31G(D,P) GEN	-7734.99462620; Eh
	10-Aug-2020	Fe_nn-PCo4-Evac-b3lyp-hsall-pcmbb-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	UB3LYP	LANL2DZ 6-31G(D) 6-31G(D,P) GEN	-7659.89524664; Eh
	10-Aug-2020	Fe_nnHS-PCo4-Eoh-b3lyp-ls-pcmb-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	UB3LYP	LANL2DZ 6-31G(D) 6-31G(D,P) GEN	-7735.66754714; Eh
	10-Aug-2020	SiCo4-Evac-b3lyp-hs-pcm-disp-bbb-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	UB3LYP	LANL2DZ 6-31G(D) 6-31G(D,P) GEN	-7578.19824197; Eh
	10-Aug-2020	SiCo4-Eooh-b3lyp-ls-pcmb-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	UB3LYP	LANL2DZ 6-31G(D) 6-31G(D,P) GEN	-7729.11226714; Eh
	10-Aug-2020	SiCo4-Eoh-b3lyp-ls-pcmbb-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	UB3LYP	LANL2DZ 6-31G(D) 6-31G(D,P) GEN	-7653.97569402; Eh
	28-Aug-2021	Ru_3a1_9_O5	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	-	6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D)	-1595.53769752; Eh
	28-Aug-2021	Ru_31a_13_oh4_LSb	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	-	6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D)	-1879.22337971; Eh
	28-Aug-2021	Co_31a_23_O5_LS_fromHS	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	-	6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D)	-
	28-Aug-2021	Cr_pbp_3_VAC_HS	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	-	6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D)	-1624.15839445; Eh

Results 11-20 of 38 (Search time: 0.002 seconds).