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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	28-Feb-2024	TS-RE_6-members	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1137.94209932; Eh
	28-Feb-2024	TS-RE	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1333.11500618; Eh
	9-Jun-2023	/HFIP_FES/TS2_hfip TS2_opt+freq_hfip	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RMN15	6-31+G(D,P) SDD GENECP	-2543.48071249; Eh
	9-Jun-2023	/HFIP_FES/TS1_hfip TS1_opt+freq_hfip	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RMN15	6-31+G(D,P) SDD GENECP	-1870.82215023; Eh
	28-Feb-2024	TS_m_CF3	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1535.27394047; Eh
	28-Feb-2024	TS_m_Cl	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1657.98320789; Eh
	28-Feb-2024	TS_m_Br	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-3771.67459589; Eh
	28-Feb-2024	TS2_A	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1294.77735789; Eh
	28-Feb-2024	TS2_AA	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1294.76168182; Eh
	28-Feb-2024	TS2_B	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1294.76602441; Eh

Results 111-120 of 133 (Search time: 0.002 seconds).