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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	6-Mar-2026	/fluronapthalene/sp/1F_isomer_3 1F_isomer_3	Charapale, Omkar	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	RMN15	CBSB3* 6-311G(2DF,2P)*	-484.7161054; Eh
	6-Mar-2026	/fluronapthalene/sp/7F_isomer_75 7F_isomer_75	Charapale, Omkar	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	RMN15	CBSB3* 6-311G(2DF,2P)*	-1079.8857088; Eh
	6-Mar-2026	/fluronapthalene/sp/8F_isomer_76 8F_isomer_76	Charapale, Omkar	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	RMN15	CBSB3* 6-311G(2DF,2P)*	-1179.0734393; Eh
	7-Nov-2024	/fragmentation_of_the_EDA_complex_with_Phtl_anion_as_donor EDA-downPhtl_ZZisomer-NEW_axb	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1487.81151389; Eh
	7-Nov-2024	/fragmentation_of_the_EDA_complex_with_Phtl_anion_as_donor EDA-downPhtl_EZisomer-NEW_axb	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1487.82362410; Eh
	7-Nov-2024	/fragmentation_of_the_EDA_complex_with_Phtl_anion_as_donor EDA-downPhtl_EZisomer_axbb	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1487.82815674; Eh
	7-Nov-2024	/fragmentation_of_the_EDA_complex_with_Phtl_anion_as_donor EDA-upPhtl_EEisomer_axb	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1487.81848083; Eh
	7-Nov-2024	/fragmentation_of_the_EDA_complex_with_Phtl_anion_as_donor EDA-upPhtl_ZZisomer_ax	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1487.80964916; Eh
	7-Nov-2024	/fragmentation_of_the_EDA_complex_with_Phtl_anion_as_donor EDA-upPhtl_ZEisomer_eq	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-1487.81736129; Eh
	7-Nov-2024	/equilibrium_between_I2_and_the_phthalonitrile_reagent benzyl_CN2_react_radicalanion	Mu, Manting	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UwB97XD	6-31G(D,P) 6-31+G(D,P) GEN	-416.688817698; Eh

Results 391511-391520 of 402241 (Search time: 0.217 seconds).