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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	5-Jan-2023	AA_Pt4_CH3OH	Garcia, Ricardo	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Sep 14 2020 08:52:35) complex	Geometry optimization	DFT	-	-641.75138893; eV
	10-Sep-2019	2_ads-m_b-1	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-365.05237118; eV
	10-Sep-2019	2_ads-b_b-2	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-364.69222875; eV
	10-Sep-2019	1_ads-t-6	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-291.79275447; eV
	10-Sep-2019	2_ads-b_b-1	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-364.95516799; eV
	10-Sep-2019	1_ads-t-4	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-291.47854430; eV
	10-Sep-2019	1_ads-t-2	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-291.75002067; eV
	10-Sep-2019	1_ads-t-1	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-291.47581009; eV
	9-Apr-2021	/CeO2 MP2c_CeO2	Schäfer, Tobias	vasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complex	Single point	DFT	-	-
	10-Sep-2019	1_ads-b-4	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-291.52538447; eV

Results 121-130 of 4289 (Search time: 0.002 seconds).