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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	12-Feb-2019	ss-CdCu-2423	García Muelas, Rodrigo	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-113.19716447; eV
	8-May-2017	Pt-2-10	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complex	Geometry optimization	-	-	-332.23367278; eV
	8-May-2017	Pd-5-04	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complex	Geometry optimization	-	-	-280.00987121; eV
	8-May-2017	Pt-6-10	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-315.77108591; eV
	20-Jul-2017	/surfaces In2O3(111)_Ovac1	Capdevila-Cortada, Marçal	vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex	Geometry optimization	-	-	-1087.24742402; eV
	20-Jul-2017	/C2H2_activation 111_C2H2_chem	Capdevila-Cortada, Marçal	vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex	Geometry optimization	-	-	-1119.24729808; eV
	20-Jul-2017	/C2H2_activation 111_Ovac_C2H2_phys	Capdevila-Cortada, Marçal	vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex	Geometry optimization	-	-	-1111.23630657; eV
	20-Jul-2017	/C2H2_activation 111_Ovac_C2H2_chem	Capdevila-Cortada, Marçal	vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex	Geometry optimization	-	-	-1112.48798172; eV
	20-Jul-2017	/H2_activation 111_adIn_2xOH	Capdevila-Cortada, Marçal	vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex	Geometry optimization	-	-	-1106.73826407; eV
	20-Jul-2017	/H2_activation 111_adIn_InH-OH	Capdevila-Cortada, Marçal	vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex	Geometry optimization	-	-	-1105.44752190; eV

Results 1761-1770 of 104079 (Search time: 0.004 seconds).