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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	6-Aug-2020	/freq/intermediates/Ag/CF fcc	Pablo-García, Sergio	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Frequencies	DFT	-	-111.24982877; eV
	10-May-2016	/full_capsule_optimisations C76_AASB	Serapian, Stefano	ADF; 2013; 01	Geometry optimization	DFT	TZP	-84.25116286; Eh
	10-May-2016	/full_capsule_optimisations C76_ABAB	Serapian, Stefano	ADF; 2013; 01	Geometry optimization	DFT	TZP	-84.26762596; Eh
	10-May-2016	/full_capsule_optimisations C76_ABSA	Serapian, Stefano	ADF; 2013; 01	Geometry optimization	DFT	TZP	-84.24598386; Eh
	2-Aug-2018	MDsnap_dimer1_1760	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2219.10196638; eV
	2-Aug-2018	MDsnap_dimer1_1780	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2218.19067705; eV
	2-Aug-2018	MDsnap_dimer1_1840	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2222.68652792; eV
	2-Aug-2018	MDsnap_dimer2_4140	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2219.25065452; eV
	2-Aug-2018	MDsnap_dimer1_260	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2219.80402372; eV
	2-Aug-2018	MDsnap_mono_3800	Fako, Edvin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-2217.71435754; eV

Results 24241-24250 of 104471 (Search time: 0.015 seconds).