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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	10-Sep-2019	5_ads-m-1	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-579.10438519; eV
	10-Sep-2019	4_ads-m_m_m_m-3	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-509.31580351; eV
	10-Sep-2019	4_ads-b_t_t_m-1	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-511.20150875; eV
	10-Sep-2019	4_ads-b_b_b_b-2	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-510.77235853; eV
	5-Jan-2023	AA_Pt4_CHOH	Garcia, Ricardo	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Aug 01 2022 17:30:49) complex	Single point	DFT	-	-632.40502497; eV
	5-Jan-2023	AA_Pt4_H2O	Garcia, Ricardo	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Aug 01 2022 17:30:49) complex	Single point	DFT	-	-625.34800100; eV
	10-Sep-2019	3_ads-b_b_t-1	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-439.31874305; eV
	5-Jan-2023	AA_Pt4_CO	Garcia, Ricardo	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Sep 14 2020 08:52:35) complex	Single point	DFT	-	-627.56992917; eV
	10-Sep-2019	1_ads-m-3	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 30 2015 22:17:36) complex	Geometry optimization	DFT	-	-290.68099774; eV
	9-Apr-2021	/O2 MP2c_O2	Schäfer, Tobias	vasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complex	Single point	DFT	-	-

Results 121-130 of 4287 (Search time: 0.001 seconds).