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Collection hits:

Collection Name
ACS_Catalysis_10_1021_acscatal_0c02514

Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	17-Jul-2025	16a__m06	Li, Yingzi	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P)	-1579.0180661; Eh
	17-Jul-2025	16a_m06	Li, Yingzi	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P)	-1579.4805906; Eh
	17-Jul-2025	21a__m06	Li, Yingzi	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P)	-1621.8679259; Eh
	17-Jul-2025	TS5_m06	Li, Yingzi	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	UM06	GENECP	-6507.8210589; Eh
	17-Jul-2025	TS3_m06	Li, Yingzi	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	UM06	GENECP	-6507.8197964; Eh
	17-Jul-2025	TS2_m06	Li, Yingzi	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	UM06	GENECP	-6507.7987324; Eh
	17-Jul-2025	TS1_m06	Li, Yingzi	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	UM06	GENECP	-3702.2427154; Eh
	17-Jul-2025	TS4_m06	Li, Yingzi	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RM06	GENECP	-5117.4754458; Eh
	17-Jul-2025	IV_m062x	Li, Yingzi	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM062X	DEF2TZVP	-1410.1036095; Eh

Results 861-870 of 12354 (Search time: 0.003 seconds).