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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	2-Oct-2023	/functional_selection/energy_calc s1_energy_wb97xd_3b	Mayer, Péter	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RwB97XD; TD-FC	GEN	-1269.7441809; Eh
	2-Oct-2023	/functional_selection/energy_calc s0_energy_wb97xd_3j	Mayer, Péter	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RwB97XD	GEN	-1462.4149511; Eh
	2-Oct-2023	/functional_selection/energy_calc s0_energy_wb97xd_3h	Mayer, Péter	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RwB97XD	GEN	-1588.8084476; Eh
	2-Oct-2023	/functional_selection geo_opt_wb97xd_3a	Mayer, Péter	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	6-311+G(D,P)	-1155.08070751; Eh
	2-Oct-2023	/functional_selection/energy_calc s1_energy_wb97xd_3a	Mayer, Péter	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RwB97XD; TD-FC	GEN	-1155.2101978; Eh
	2-Oct-2023	/functional_selection geo_opt_wb97xd_3b	Mayer, Péter	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	6-311+G(D,P)	-1269.59997363; Eh
	2-Oct-2023	/functional_selection/energy_calc s1_energy_wb97xd_3f	Mayer, Péter	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RwB97XD; TD-FC	GEN	-1359.7370515; Eh
	2-Oct-2023	/functional_selection/energy_calc s1_energy_wb97xd_3h	Mayer, Péter	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RwB97XD; TD-FC	GEN	-1588.8084476; Eh
	2-Oct-2023	/functional_selection/energy_calc s0_energy_wb97xd_3b	Mayer, Péter	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RwB97XD	GEN	-1269.7441809; Eh
	2-Oct-2023	/functional_selection/energy_calc s1_energy_wb97xd_3j	Mayer, Péter	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RwB97XD; TD-FC	GEN	-1462.4149511; Eh

Results 1-10 of 15 (Search time: 0.001 seconds).