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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	19-Sep-2018	/2_electrons/2_H+/Mo2O2S6H2 BA1	Bandeira, Nuno	ADF; 2017	Geometry optimization Minimum	DFT	TZ2P	-2.92888244; Eh
	2-Aug-2018	MDsnap_trimer1_1620	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2222.65469684; eV
	2-Aug-2018	MDsnap_trimer1_1000	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2222.39371610; eV
	2-Aug-2018	MDsnap_dimer1_4120	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2220.77063797; eV
	2-Aug-2018	MDsnap_dimer1_2780	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2221.35624932; eV
	2-Aug-2018	MDsnap_dimer1_3060	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2221.56321589; eV
	2-Aug-2018	MDsnap_dimer1_2540	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2220.47475589; eV
	2-Aug-2018	MDsnap_dimer1_500	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2217.52069895; eV
	2-Aug-2018	MDsnap_trimer1_3080	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2221.96340916; eV
	19-Sep-2018	/2_electrons/2_H+/Mo2O2S8H2 BB6	Bandeira, Nuno	ADF; 2017	Geometry optimization Minimum	DFT	TZ2P	-3.19688253; Eh

Results 31441-31450 of 104079 (Search time: 0.02 seconds).