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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	29-Jul-2021	V06O19_0H	Petrus, Enric	ADF; 2019	Geometry optimization	PBE	TZP	-8.26597188; Eh
	4-Aug-2022	/Sampling Pt-2O-surfvac-4ce3-pos_28_30_34_35-gamma	Geiger, Julian	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 02 2020 11:25:42) gamma-only	Geometry optimization	DFT	-	-850.57252712; eV
	4-Aug-2022	/Sampling Pt-2O-surfvac-4ce3-pos_28_31_35_36-gamma	Geiger, Julian	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 02 2020 11:25:42) gamma-only	Geometry optimization	DFT	-	-850.79095141; eV
	4-Aug-2022	/Sampling Pt-2O-surfvac-4ce3-pos_28_29_31_36-gamma	Geiger, Julian	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 02 2020 11:25:42) gamma-only	Geometry optimization	DFT	-	-850.54206753; eV
	4-Aug-2022	/Sampling pris-2O-surfvac-2ce3-pos_29_35-gamma	Geiger, Julian	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	DFT	-	-843.87177382; eV
	4-Aug-2022	/Sampling Pt-2O-surfvac-4ce3-pos_28_29_34_35-gamma	Geiger, Julian	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 02 2020 11:25:42) gamma-only	Geometry optimization	DFT	-	-850.48410374; eV
	4-Aug-2022	/Sampling Pt-2O-surfvac-4ce3-pos_28_29_31_35-gamma	Geiger, Julian	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 02 2020 11:25:42) gamma-only	Geometry optimization	DFT	-	-850.47756681; eV
	4-Aug-2022	/Sampling Pt-2O-surfvac-4ce3-pos_28_29_33_34-gamma	Geiger, Julian	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 02 2020 11:25:42) gamma-only	Geometry optimization	DFT	-	-850.61428093; eV
	4-Aug-2022	/Sampling pris-2O-surfvac-2ce3-pos_29_33-gamma	Geiger, Julian	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	DFT	-	-844.41442709; eV
	4-Aug-2022	/Sampling pris-2O-surfvac-2ce3-pos_28_36-k3x3	Geiger, Julian	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-844.74076103; eV

Results 23001-23010 of 101944 (Search time: 0.013 seconds).