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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/group2/ru/0001 ru-2601-a	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-463.79367318; eV
	31-Jan-2022	/Cluster_(R) IS_Co-O_Cluster_(R)	Hegner, Franziska Simone	Gaussian; 09; EM64L-G09RevD.01	Single point Minimum	UTPSSh	DEF2TZVP DEF2SVP GEN	-3652.02683697; Eh
	25-Jun-2024	/Intermediates/Cu/110 C3H6	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-300.71644849; eV
	16-Jan-2026	/FG_dataset/group2/ru/0001 ru-2611-a	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-469.71690148; eV
	2-Oct-2023	/CWO_del_config CWO_H2O_2-OH2	Benzidi, Hind	vasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complex	N/A	DFT	-	-781.92486200; eV
	2-Oct-2023	/CoSbO4 CoSbO4_del	Benzidi, Hind	vasp; 5.3.3; 18Dez12 (build Mar 13 2019 16:05:56) complex	Single point	DFT	-	-99.58031780; eV
	2-Oct-2023	/CoSbO4 CoSbO4_defect	Benzidi, Hind	vasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complex	N/A	DFT	-	-109.77315040; eV
	1-Jul-2023	pristine-3xN6-Ru-4xN6-8.89_22	Ruiz, Andrea	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-1968.16311620; eV
	1-Jul-2023	pristine-4xN6-pristine-4xN6-4.26_02	Ruiz, Andrea	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-1947.74096406; eV
	1-Jul-2023	pristine-4xN6-pristine-4xN6-4.26_01	Ruiz, Andrea	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-1946.66246506; eV

Results 30121-30130 of 103542 (Search time: 0.018 seconds).