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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	24-Oct-2023	O2,_dir_Ag20_abs1	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-52.03473626; eV
	24-Oct-2023	1oxy,_dir_Ag20_GCN_3_67	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-47.83518509; eV
	24-Oct-2023	1oxy,_dir_Ag20_GCN_2_73	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-46.60177120; eV
	24-Oct-2023	1oxy,_dir_Ag20_GCN_2_0	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-47.44897517; eV
	24-Oct-2023	edge,_dir_Ag140_12_oxy_continum	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-414.53588935; eV
	24-Oct-2023	more_than_7_edge,_dir_Ag140_11oxy	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-408.64983828; eV
	24-Oct-2023	O2,_dir_Ag20_abs3	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-52.03964306; eV
	24-Oct-2023	edge,_dir_Ag140_42oxy_12edges	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-583.62211947; eV
	24-Oct-2023	edge,_dir_Ag140_18oxy_4edges	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-448.72147400; eV
	24-Oct-2023	O2,_dir_Ag20_abs8	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-52.11234674; eV

Results 1-10 of 33 (Search time: 0.001 seconds).