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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	10-Jul-2017	Keggin-TS_epim-H4GeMo12O40	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-only	Geometry optimization	-	-	-545.09498260; eV
	10-Jul-2017	Keggin-M_diss-H3AsMo12O40	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-only	Geometry optimization	-	-	-541.33942692; eV
	10-Jul-2017	Keggin-G_diss-H4GeMo12O40	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-only	Geometry optimization	-	-	-546.19134510; eV
	10-Jul-2017	Keggin-TS_epim-H4SiMo12O40	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-only	Geometry optimization	-	-	-549.40600571; eV
	10-Jul-2017	Keggin-M_diss-H4SiMo12O40	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-only	Geometry optimization	-	-	-550.53083802; eV
	10-Jul-2017	MoO3-G_diss	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	-	-	-1221.80930206; eV
	10-Jul-2017	Keggin-M_diss-H4GeMo12O40	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-only	Geometry optimization	-	-	-546.25081412; eV
	10-Jul-2017	H3AsMo12O40-OtH	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-only	Geometry optimization	-	-	-407.15846824; eV
	10-Jul-2017	H4GeMo12O40-OtH	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-only	Geometry optimization	-	-	-412.16783310; eV
	10-Jul-2017	H4SiMo12O40	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-only	Geometry optimization	-	-	-412.78793152; eV

Results 1301-1310 of 2385 (Search time: 0.001 seconds).