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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	8-Apr-2024	/figure_1 1TS1LiE	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1463.46570269; Eh
	7-Apr-2024	TS2_CC	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1294.70790193; Eh
	7-Apr-2024	TS5_6-members	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1101.50446323; Eh
	23-Apr-2024	BioIIIts_log	Tantillo, Dean	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-884.326661689; Eh
	28-Feb-2024	TS3	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1200.39889345; Eh
	28-Feb-2024	TS7	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1525.65211560; Eh
	28-Feb-2024	TS6	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1525.64903168; Eh
	28-Feb-2024	TS5	Alves, Erick	Gaussian; 16; EM64L-G16RevC.01	Geometry optimization TS	RM06L	DEF2SVP	-1296.69857219; Eh
	7-May-2024	c3ab-co3a-cp	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	SDD 6-31G(D,P) GEN	-1939.30911743; Eh
	7-May-2024	c5ab-co3a-cp	Cambeiro, Xacobe	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RwB97XD	SDD 6-31G(D,P) GEN	-1939.31760728; Eh

Results 1421-1430 of 1466 (Search time: 0.003 seconds).