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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	24-Oct-2023	7oxy,_dir_Ag140_70xy_edge	Bruix, Albert	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-only	Geometry optimization	DFT	-	-385.68228784; eV
	24-Oct-2023	4oxy,_dir_Ag140_4oxy_4fold	Bruix, Albert	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-only	Geometry optimization	DFT	-	-369.27127944; eV
	24-Oct-2023	1oxy,_dir_Ag140_GCN7_17	Bruix, Albert	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-only	Geometry optimization	DFT	-	-350.86908071; eV
	24-Oct-2023	1oxy,_dir_Ag140_GCN5_72	Bruix, Albert	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-only	Geometry optimization	DFT	-	-351.29293205; eV
	24-Oct-2023	1oxy,_dir_Ag140_GCN2_92	Bruix, Albert	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-only	Geometry optimization	DFT	-	-351.63197268; eV
	24-Oct-2023	o_2oxy,_dir_Ag20_2oxy_prova1	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-52.91088956; eV
	24-Oct-2023	O2,_dir_Ag20_abs7	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-52.16419245; eV
	24-Oct-2023	O2,_dir_Ag20_abs10	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-52.15806663; eV
	24-Oct-2023	1oxy,_dir_Ag20_GCN_2_67	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-47.67639562; eV
	24-Oct-2023	1oxy,_dir_Ag20_GCN_1_73	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only	Geometry optimization	DFT	-	-47.53294686; eV

Results 41-50 of 63 (Search time: 0.002 seconds).