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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/H2O/phonopy/disp_014 disp_014	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Single point	DFT	-	-13.43419861; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/H2O/phonopy/disp_013 disp_013	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Single point	DFT	-	-13.43400650; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/H2O/phonopy/disp_012 disp_012	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Single point	DFT	-	-13.43656190; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/CuOH_4 CuOH_4	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-60.86288826; eV
	16-Jan-2026	/FG_dataset/carbamate_esters/pd/111 pd-49_3-a	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-334.25569644; eV
	16-Jan-2026	/FG_dataset/carbamate_esters/pd/111 pd-49_1-a	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-334.10341274; eV
	16-Jan-2026	/FG_dataset/carbamate_esters/pd/111 pd-49_2-a	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-334.04707272; eV
	16-Jan-2026	/FG_dataset/group4/ni/111 ni-3622-a	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-314.16954258; eV
	16-Jan-2026	/FG_dataset/group4/ni/111 ni-3621-a	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-314.57995625; eV
	8-Apr-2025	/Reactivity octa25-1-CO	Ibáñez-Alé, Enric	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-

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