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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/CuOH_2_2/phonopy/disp_019 disp_019	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-121.36236337; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/CuOH_2_2/phonopy/disp_006 disp_006	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-121.36145461; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/Cu2WO4/phonopy/disp_059 disp_059	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-5036.16172431; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/Cu2WO4/phonopy/disp_035 disp_035	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-5036.16501158; eV
	2-Jul-2025	/Bulk_structure/CuWO4_3/bulk/INCAR_config_5 U_2_2	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-724.23944714; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/CuOH2/phonopy/disp_016 disp_016	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Single point	DFT	-	-31.23912679; eV
	2-Jul-2025	/Bulk_structure/CuWO4_2/surf/slab_100 slab_100	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complex	Single point	DFT	-	-40690.52407638; eV
	2-Jul-2025	/Bulk_structure/CuWOx/O_vacc O_vacc	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-91.33761901; eV
	2-Jul-2025	/CuOx_testDD/model_1/OH OH	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complex	Single point	DFT	-	-473.61263346; eV
	2-Jul-2025	/Bulk_structure/CuWO4_2/CuWO4_110_surface_defects/oxygen_vacancies/O_vac_surface_double O_vac_surface_double	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complex	Single point	DFT	-	-40738.64402446; eV

Results 93991-94000 of 94148 (Search time: 0.054 seconds).