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Item hits:

Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy
18-Nov-2019	Ti_d5d_Cp1	Vlahovic, Filip	ADF; 2013; 01	Single point	DFT	TZP	-
18-Nov-2019	Ti_d5d_Cp2_EDA	Vlahovic, Filip	ADF; 2013; 01	Single point	DFT	-	-
18-Nov-2019	Ti_d5h_f1	Vlahovic, Filip	ADF; 2013; 01	Single point	DFT	TZP	-
30-Oct-2017	M0_Orca	Borowski, Tomasz	Orca; 3.0.3; RELEASE	Single point	DFT	SV(P)	-2862.45069923; Eh
30-Oct-2017	M1_Orca	Borowski, Tomasz	Orca; 3.0.2; RELEASE	Single point	DFT	SV(P)	-3892.11734351; Eh
30-Oct-2017	M3_Orca	Borowski, Tomasz	Orca; 3.0.2; RELEASE	Single point	DFT	SV(P)	-3303.10200513; Eh
30-Oct-2017	M2_Orca	Borowski, Tomasz	Orca; 3.0.3; RELEASE	Single point	DFT	SV(P)	-3739.35147842; Eh

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