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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	29-Jan-2016	M3(Opt)	Serapian, Stefano	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RPBEPBE	6-311G(d,p); LANL2DZ	-5146.12311564; Eh
	10-May-2016	/full_capsule_optimisations C90_SBSB	Serapian, Stefano	ADF; 2013; 01	Geometry optimization	DFT	TZP	-88.92569861; Eh
	10-May-2016	/full_capsule_optimisations C90_AAAA	Serapian, Stefano	ADF; 2013; 01	Geometry optimization	DFT	TZP	-88.87984307; Eh
	10-May-2016	/full_capsule_optimisations C90_AASB	Serapian, Stefano	ADF; 2013; 01	Geometry optimization	DFT	TZP	-88.89612694; Eh
	10-May-2016	/full_capsule_optimisations C90_ABAB	Serapian, Stefano	ADF; 2013; 01	Geometry optimization	DFT	TZP	-88.91908123; Eh
	29-Jan-2016	M45-4+_in_P-1_(Freq)	Serapian, Stefano	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Structure	RPBEPBE	6-311G(d,p); LANL2DZ	-5614.98023339; Eh
	29-Jan-2016	M90-4+_in_P-1_(Freq)	Serapian, Stefano	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Structure	RPBEPBE	6-311G(d,p); LANL2DZ	-5614.98353364; Eh
	29-Jan-2016	M90-4+_in_P-1_(Opt)	Serapian, Stefano	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RPBEPBE	6-311G(d,p); LANL2DZ	-5614.98353364; Eh
	29-Jan-2016	M45-4+_in_P-1_(Opt)	Serapian, Stefano	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RPBEPBE	6-311G(d,p); LANL2DZ	-5614.98023339; Eh
	29-Jan-2016	M5(Freq)	Serapian, Stefano	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Structure	RPBEPBE	6-311G(d,p); LANL2DZ	-5146.12189337; Eh

Results 33751-33760 of 104079 (Search time: 0.02 seconds).