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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	20-Dec-2017	d-15-Initial	Scharfe, Matthias	vasp; 5.3.5; 31Mar14 (build Jun 03 2014 15:06:09) complex	Geometry optimization	-	-	-700.65329528; eV
	20-Dec-2017	d-9-Final	Scharfe, Matthias	vasp; 5.3.5; 31Mar14 (build Jun 03 2014 15:06:09) complex	Geometry optimization	-	-	-695.11571530; eV
	20-Dec-2017	d-13-Final	Scharfe, Matthias	vasp; 5.3.5; 31Mar14 (build Jun 03 2014 15:06:09) complex	Geometry optimization	-	-	-701.10724402; eV
	20-Dec-2017	d-2a-Final	Scharfe, Matthias	vasp; 5.3.5; 31Mar14 (build Jun 03 2014 15:06:09) complex	Geometry optimization	-	-	-692.91267797; eV
	20-Dec-2017	d-8-Final	Scharfe, Matthias	vasp; 5.3.5; 31Mar14 (build Jun 03 2014 15:06:09) complex	Geometry optimization	-	-	-692.91267797; eV
	20-Dec-2017	d-10-Initial	Scharfe, Matthias	vasp; 5.3.5; 31Mar14 (build Jun 03 2014 15:06:09) complex	Geometry optimization	-	-	-702.38833034; eV
	20-May-2019	/FePO4 3_EaOC_Ofc_Hstrip_Final	Scharfe, Matthias	vasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complex	Geometry optimization	DFT	-	-1247.95361862; eV
	20-May-2019	/FePO4 3_EaOC_Cl_Hstrip_Final	Scharfe, Matthias	vasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complex	Geometry optimization	DFT	-	-1254.63833036; eV
	20-May-2019	/FePO4 5_EaOC_Ofc_H-Clstrip_Initial	Scharfe, Matthias	vasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complex	Geometry optimization	DFT	-	-1249.24093768; eV
	20-May-2019	/FePO4 4_EaOC_Cl_Clstrip_Final	Scharfe, Matthias	vasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complex	Geometry optimization	DFT	-	-1248.47654672; eV

Results 51-60 of 2587 (Search time: 0.002 seconds).