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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	16-Jan-2026	/FG_dataset/group4/os/0001 os-1231-a	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-556.53381689; eV
	16-Jan-2026	/FG_dataset/group4/os/0001 os-1221-a	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-548.88787124; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/CuOH2/phonopy/disp_025 disp_025	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Single point	DFT	-	-31.23891215; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/CuOH2/phonopy/disp_027 disp_027	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Single point	DFT	-	-31.24009975; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/CuOH2/phonopy/disp_026 disp_026	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Single point	DFT	-	-31.23991132; eV
	24-Apr-2025	/DOS Ag(111)-(3x3)-CO2-DOS	Dattila, Federico	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-115.22312929; eV
	24-Apr-2025	/DOS Co(0001)-(3x3)-CO2-DOS	Dattila, Federico	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-257.73693964; eV
	24-Apr-2025	/DOS Au(111)-(3x3)-CO2-DOS	Dattila, Federico	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-134.61693612; eV
	24-Apr-2025	/redCO2 Ru(0001)-(3x3)-COOH	Dattila, Federico	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-
	24-Apr-2025	/redCO2 Ru(0001)-(3x3)-CO2	Dattila, Federico	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-

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