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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	10-May-2017	Pd-CS-H2COH_(solvated)	Garcia-Ratés, Miquel	vasp; 5.3.3; 18Dez12 (build Aug 29 2016 09:59:29) complex	Geometry optimization	-	-	-268.48778309; eV
	10-May-2017	Ru-CS-H3COH_(solvated)	Garcia-Ratés, Miquel	vasp; 5.3.3; 18Dez12 (build Aug 29 2016 09:59:29) complex	Geometry optimization	-	-	-454.79783983; eV
	10-May-2017	Pd-CS-H2O_(vacuum)	Garcia-Ratés, Miquel	vasp; 5.3.5; 31Mar14 (build May 13 2015 15:04:06) complex	Geometry optimization	-	-	-255.84651515; eV
	10-May-2017	Pt-CS-H2O_(vacuum)	Garcia-Ratés, Miquel	vasp; 5.3.5; 31Mar14 (build May 13 2015 15:04:06) complex	Geometry optimization	-	-	-297.34642094; eV
	10-May-2017	Ru-CS-H2O_(vacuum)	Garcia-Ratés, Miquel	vasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complex	Geometry optimization	-	-	-437.81768309; eV
	10-May-2017	Pd-S2W-TS-H3CO-H2CO_(vacuum)	Garcia-Ratés, Miquel	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-300.85218106; eV
	10-May-2017	Pd-S2W-H3COH_(solvated)	Garcia-Ratés, Miquel	vasp; 5.3.3; 18Dez12 (build Aug 29 2016 09:59:29) complex	Geometry optimization	-	-	-302.49921485; eV
	10-May-2017	Pt-S2W-H3COH_(solvated)	Garcia-Ratés, Miquel	vasp; 5.3.3; 18Dez12 (build Aug 29 2016 09:59:29) complex	Geometry optimization	-	-	-344.05886417; eV
	10-May-2017	Pd-S2W-H3CO_(vacuum)	Garcia-Ratés, Miquel	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-301.40656853; eV
	10-May-2017	Pd-S2W-H3COH_(vacuum)	Garcia-Ratés, Miquel	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-301.59391653; eV

Results 9601-9610 of 103542 (Search time: 0.008 seconds).