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Item hits:

Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy
11-Apr-2017	/NiCo2P2/opt ts_h2o_2	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Single point	-	-	-608.44433256; eV
11-Apr-2017	/NiCo2P2/opt ts_h2o_1	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Single point	-	-	-600.90421509; eV
11-Apr-2017	/NiCo2P2/opt ts_4b_h	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Single point	-	-	-640.07767092; eV
11-Apr-2017	/NiCo2P2/opt 6B4	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	-	-	-633.55774431; eV
11-Apr-2017	/NiCo2P2/opt 7B4	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	-	-	-633.39318424; eV
11-Apr-2017	/NiCo2P2/opt ts_3b4b	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Single point	-	-	-639.03358724; eV
11-Apr-2017	/NiCo2P2/opt BNH6	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	-	-	-625.72916085; eV
11-Apr-2017	/NiCo2P2/opt H2O	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	-	-	-601.89560068; eV
11-Apr-2017	/NiCo2P2/opt Bulk	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	-	-	-59.97436973; eV
11-Apr-2017	/NiCo2P2/opt H2	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complex	Geometry optimization	-	-	-594.60391655; eV

Results 8661-8670 of 103542 (Search time: 0.007 seconds).