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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	11-Apr-2017	/NiCo2P2/opt 1x1	Li, Qiang	vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex	Geometry optimization	-	-	-146.81170771; eV
	11-Apr-2017	/Ni3P2/opt ts_7b6b	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Single point	-	-	-572.22073839; eV
	11-Apr-2017	/Ni3P2/opt BNH6	Li, Qiang	vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex	Geometry optimization	-	-	-565.01401951; eV
	11-Apr-2017	/NiCo2P2/opt OH	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	-	-	-598.83853187; eV
	11-Apr-2017	/Ni3P2/opt Bulk	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-53.38234135; eV
	11-Apr-2017	/NiCo2P2/opt 2x2	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Single point	-	-	-587.33697528; eV
	17-Oct-2016	/Dimer/Al_Cl_I/Insertion/Extra/Scans/Scan2/Tests 3	González Fabra, Joan	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization TS	RB97D3	6-31G*	-2868.26391288; Eh
	11-Apr-2017	/Ni3P2/opt H_hollow	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	-	-	-530.85525860; eV
	11-Apr-2017	/Ni3P2/opt ts_h2o_2	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Single point	-	-	-547.44399225; eV
	11-Apr-2017	/Ni3P2/opt 7B4	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	-	-	-572.23909621; eV

Results 8701-8710 of 103542 (Search time: 0.008 seconds).