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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	1-Mar-2024	/Metal_structures/Cu_structures Cu15	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-38.57038866; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu12	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-29.59689801; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu37	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-105.64631027; eV
	27-May-2024	PW9_Ti-Oallyl-OOH_HOSi	Solé-Daura, Albert	Gaussian; 09; EM64L-G09RevA.02	Geometry optimization Minimum	RB3LYP	GENECP	-
	1-Mar-2024	/Metal_structures/Cu_structures Cu-bulk-15	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-14.57150515; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu13-1	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-32.11151883; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu13-3	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-31.90709776; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu111	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-223.70563508; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu100	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-109.52549268; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu32	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-90.46846603; eV

Results 1281-1290 of 2835 (Search time: 0.001 seconds).