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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	30-Oct-2023	/Single_Point I_c16_SP	Sharma, Akhilesh Kumar	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	CC-PVTZ GENECP	-1124.5853513; Eh
	30-Oct-2023	/Single_Point I_c17_SP	Sharma, Akhilesh Kumar	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	CC-PVTZ GENECP	-1124.5856213; Eh
	30-Oct-2023	/Single_Point I_c18_SP	Sharma, Akhilesh Kumar	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	CC-PVTZ GENECP	-1124.5858864; Eh
	30-Oct-2023	/Single_Point I_c13_SP	Sharma, Akhilesh Kumar	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	CC-PVTZ GENECP	-1124.5862616; Eh
	30-Oct-2023	/Single_Point I_c14_SP	Sharma, Akhilesh Kumar	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	CC-PVTZ GENECP	-1124.5850331; Eh
	19-Mar-2026	/SiTaW Si01Ta03W08O39-2H-iso-29030413	Buils, Jordi	ADF; 2019	Geometry optimization	PBE	TZP	-17.49397838; Eh
	30-Oct-2023	/Single_Point IV_c10_SP	Sharma, Akhilesh Kumar	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	CC-PVTZ GENECP	-1124.5759307; Eh
	30-Oct-2023	/Single_Point IV_c9_SP	Sharma, Akhilesh Kumar	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	CC-PVTZ GENECP	-1124.5761184; Eh
	30-Oct-2023	/Single_Point IV_c7_SP	Sharma, Akhilesh Kumar	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	CC-PVTZ GENECP	-1124.5768872; Eh
	30-Oct-2023	/Single_Point IV_c6_SP	Sharma, Akhilesh Kumar	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	CC-PVTZ GENECP	-1124.5768976; Eh

Results 42161-42170 of 103542 (Search time: 0.022 seconds).