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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	2-Sep-2023	/P_radicals/dppf/dppf+Ph-rad_TS dppf+Ph-rad_TS	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	UMN15L	DEF2SVP	-3487.23384359; Eh
	2-Sep-2023	/P_radicals/dppf/dppf+Ph-cat dppf+Ph-cat	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RMN15L	DEF2SVP	-3487.14166216; Eh
	2-Sep-2023	/P_radicals/dppf/dppf dppf_tzvp	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RMN15	DEF2TZVP	-3257.7291348; Eh
	2-Sep-2023	/P_radicals/dppf/dppf dppf	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RMN15L	DEF2SVP	-3256.08577627; Eh
	2-Sep-2023	/Me_radical_addn/Benzene benzene_tzvp	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RMN15	DEF2TZVP	-232.0336578; Eh
	2-Sep-2023	/Me_radical_addn/Me_radical Me_radical_tzvp	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	UMN15	DEF2TZVP	-39.7888613; Eh
	2-Sep-2023	/Me_radical_addn/Me_radical Me_radical	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UMN15L	DEF2SVP	-39.7493930418; Eh
	2-Sep-2023	/Me_radical_addn/Benzene benzene	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RMN15L	DEF2SVP	-231.828039430; Eh
	2-Sep-2023	/common/iodobenzene iodobenzene_tzvp-as-radanion	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	UMN15	DEF2TZVP	-528.4348363; Eh
	2-Sep-2023	/common/iodobenzene iodobenzene_tzvp	Nelson, David	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RMN15	DEF2TZVP	-528.4234603; Eh

Results 1231-1240 of 1523 (Search time: 0.004 seconds).