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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	28-Nov-2017	ol-AgPd-0011	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-159.41688412; eV
	28-Nov-2017	ol-AgRe-0011	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-228.60851750; eV
	28-Nov-2017	ol-AgPt-0011	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-168.89049601; eV
	28-Nov-2017	ol-AgOs-0011	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-212.25239083; eV
	16-Jan-2026	/FG_dataset/amidines/au/111 au-4aZb-a	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-241.40103290; eV
	29-Jan-2016	M2(Freq)	Serapian, Stefano	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Structure	RPBEPBE	6-311G(d,p); LANL2DZ	-5146.12307238; Eh
	29-Jan-2016	M2(Opt)	Serapian, Stefano	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RPBEPBE	6-311G(d,p); LANL2DZ	-5146.12307238; 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 C84_ABSA	Serapian, Stefano	ADF; 2013; 01	Geometry optimization	DFT	TZP	-86.93645548; Eh

Results 25311-25320 of 104592 (Search time: 0.018 seconds).