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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	29-Oct-2025	/SF/SF_opt f_1int1n	Villares, Mario	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RwB97XD	6-31G(D,P) GEN	-919.685666224; Eh
	29-Oct-2025	/S2_triplet/S2_triplet_sp s2_3ts1o	Villares, Mario	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	UwB97XD	GEN	-1218.1038074; Eh
	29-Oct-2025	/S2F/S2F_sp f2_1ts4oa	Villares, Mario	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RwB97XD	GEN	-1318.1730932; Eh
	29-Oct-2025	/S8F/S8F_opt f8_1ts4ob	Villares, Mario	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RwB97XD	6-31G(D,P) GEN	-3706.90865493; Eh
	29-Oct-2025	/reac_prod_actspec_cyc/opt s5_open	Villares, Mario	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RwB97XD	6-31G(D,P) GEN	-1991.12093848; Eh
	29-Oct-2025	/S8F/S8F_opt f8_1ts3ob	Villares, Mario	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RwB97XD	6-31G(D,P) GEN	-819.780366064; Eh
	29-Oct-2025	/self_act_st_cycpr/self_act_st_cycpr_opt ts2n	Villares, Mario	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RwB97XD	GEN	-3607.4514089; Eh
	29-Oct-2025	/SF/SF_sp ts_f_1ts1o	Villares, Mario	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RwB97XD	GEN	-919.8880102; Eh
	29-Oct-2025	/reac_prod_actspec_cyc/sp s2	Villares, Mario	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RwB97XD	GEN	-796.3662853; Eh
	29-Oct-2025	/SF/SF_sp f_1int1o	Villares, Mario	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RwB97XD	GEN	-919.9336783; Eh

Results 2291-2300 of 2546 (Search time: 0.002 seconds).