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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	28-Oct-2022	/N_din6_as_c3_253 rel_111	Minotaki, Maria	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-615.00650759; eV
	28-Oct-2022	/N_din6_as_c4_2346 dos	Minotaki, Maria	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-616.22522587; eV
	28-Oct-2022	/N_din6_as_c4_3456 dos	Minotaki, Maria	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-616.45369567; eV
	28-Oct-2022	/N_din6_as_c3_216 dos	Minotaki, Maria	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-617.26217699; eV
	28-Oct-2022	/N_din6_as_c5_12345 sc	Minotaki, Maria	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-615.14651915; eV
	28-Oct-2022	/N_din6_as_c5_12346 sc	Minotaki, Maria	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-616.89134605; eV
	14-Jun-2024	/Au144_clusters/Au144 Au143Cus_00-00_OCO	Ibáñez-Alé, Enric	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 02 2020 11:25:42) gamma-only	Single point	DFT	-	-1898.42725821; eV
	19-Mar-2026	/SiTaW Si01Ta03W09O40-1H-iso-29060736	Buils, Jordi	ADF; 2019	Geometry optimization	PBE	TZP	-17.78334744; Eh
	28-Oct-2022	/N_din6_as_c4_2346 rel_111	Minotaki, Maria	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-615.86982404; eV
	28-Oct-2022	/N_din6_as_c3_216 rel_331	Minotaki, Maria	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-617.26489733; eV

Results 30501-30510 of 103542 (Search time: 0.019 seconds).