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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	22-Jun-2018	/Vacancy_formation vac_surf_2Mo5	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	PBE+U	-	-1076.11357370; eV
	22-Jun-2018	/Propen2ol_Propanone Propanone	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	PBE+U	-	-1133.95508610; eV
	22-Jun-2018	/2Propanol_Propylene Propylene	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	PBE+U	-	-1140.39913638; eV
	22-Jun-2018	/Propen2ol_Propanone P2ol	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	PBE+U	-	-1132.98197065; eV
	22-Jun-2018	/Vacancy_formation clean_surf	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	PBE+U	-	-1083.65661917; eV
	22-Jun-2018	/12Enol_Acetol 12enol	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	PBE+U	-	-1139.31401015; eV
	22-Jun-2018	/2Propenol_Propylene 2propenolH	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	PBE+U	-	-1132.64342758; eV
	22-Jun-2018	/Vacancy_formation H2Ot_MoO3	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	PBE+U	-	-1091.63890549; eV
	22-Jun-2018	/2Propenol_Propylene 2propenol	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	PBE+U	-	-1132.07220340; eV
	22-Jun-2018	/2Propenol_Propylene Propylene	Rellán, Marcos	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	PBE+U	-	-1132.43692081; eV

Results 11491-11500 of 104079 (Search time: 0.008 seconds).