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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	25-Sep-2025	/side_reactions ts_water_protonation	Rocha Guimaraes, Ana Beatriz	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization TS	RB3LYP	DEF2SVP	-632.237964059; Eh
	25-Sep-2025	/side_reactions sp_ts_rad_HFIP_change	Rocha Guimaraes, Ana Beatriz	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UB3LYP	DEF2TZVPP	-789.445353; Eh
	10-Sep-2025	/System_S_with_the_silyl_group_ Sg	Apaloo-Messan, Edmond	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G(D) LANL2DZ GENECP	-1885.17666895; Eh
	25-Sep-2025	/HFIP_mechanism sp_²R1b	Rocha Guimaraes, Ana Beatriz	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UB3LYP	DEF2TZVPP	-557.0769165; Eh
	25-Sep-2025	/side_reactions sp_²R4a	Rocha Guimaraes, Ana Beatriz	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UB3LYP	DEF2TZVPP	-789.5198337; Eh
	17-Jul-2025	25a__m06	Li, Yingzi	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06	6-311+G(D,P)	-960.5404366; Eh
	17-Jul-2025	21d__m06	Li, Yingzi	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	GENECP	-852.0450126; Eh
	25-Sep-2025	/HFIP_mechanism ²R1a	Rocha Guimaraes, Ana Beatriz	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	DEF2SVP	-567.459661586; Eh
	25-Sep-2025	/HFIP_mechanism ²R2a	Rocha Guimaraes, Ana Beatriz	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	UB3LYP	DEF2SVP	-114.968625228; Eh
	25-Sep-2025	/side_reactions sp_ts_ketone_formation	Rocha Guimaraes, Ana Beatriz	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RB3LYP	DEF2TZVPP	-865.3663475; Eh

Results 11731-11740 of 12948 (Search time: 0.009 seconds).