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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 Cu6-m5	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-12.09480496; eV
	1-Mar-2024	/Gas_phase CO(g)	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-14.80487855; eV
	26-Sep-2024	U2_in_UN@C2(13)-C84_NOSYM	Rosello, Yannick	ADF; 2019; 306	Single point	PBE0 == Not Default ==	TZP	-34.21621869; Eh
	1-Mar-2024	/Metal_structures/NiCu_structures NiCu3-cubic	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-16.60432792; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu38-m20	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-92.74720578; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu38-25	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-99.62381808; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu38-5	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-111.71646561; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu14-20	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-31.00817120; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu19-m5	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-50.63636909; eV
	1-Mar-2024	/Metal_structures/Cu_structures Cu14	Strugovshchikov, Evgenii	vasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complex	Geometry optimization	DFT	-	-35.22009479; eV

Results 1231-1240 of 2579 (Search time: 0.001 seconds).