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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	10-Sep-2019	3_ads-t_t_t-1	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-439.16261082; eV
	10-Sep-2019	3_ads-t_t_t-2	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-438.70222910; eV
	10-Sep-2019	3_ads-m_m_t-1	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-438.48567961; eV
	10-Sep-2019	3_ads-m_m_b-1	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-438.38717586; eV
	10-Sep-2019	2_ads-m_t-5	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-364.71429229; eV
	10-Sep-2019	2_ads-m_t-2	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-364.77886319; eV
	5-Jan-2023	AA_Pt4_COH	Garcia, Ricardo	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Sep 14 2020 09:34:00) complex	Geometry optimization	DFT	-	-630.38806979; eV
	10-Sep-2019	2_ads-m_m-3	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-363.22574952; eV
	10-Sep-2019	2_ads-m_m-1	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complex	Geometry optimization	DFT	-	-363.35611009; eV
	10-Sep-2019	Cysteine_molecule	Mates Torres, Eric	vasp; 5.4.1; 24Jun15 (build Dec 20 2017 10:32:10) gamma-only	Geometry optimization	DFT	-	-73.42876860; eV

Results 71-80 of 4287 (Search time: 0.002 seconds).