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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/Cu2WO4/phonopy/disp_012 disp_012	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-5036.16060276; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/Cu2WO4/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	-	-5036.16315467; eV
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/Cu2WO4/phonopy/disp_007 disp_007	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-5036.16117422; eV
	19-Mar-2026	/Ta Ta09O27-2H-iso-0	Buils, Jordi	ADF; 2019	Geometry optimization	PBE	TZP	-12.90375977; Eh
	19-Mar-2026	/Ta Ta05O14-1H-iso-0	Buils, Jordi	ADF; 2019	Geometry optimization	PBE	TZP	-6.56565112; Eh
	19-Mar-2026	/Ta Ta02O7-2H-iso-0	Buils, Jordi	ADF; 2019	Geometry optimization	PBE	TZP	-3.34143609; Eh
	19-Mar-2026	/Ta Ta06O19-0H-iso-0	Buils, Jordi	ADF; 2019	Geometry optimization	PBE	TZP	-9.01670878; Eh
	19-Mar-2026	/Ta Ta04O12-0H-iso-0	Buils, Jordi	ADF; 2019	Geometry optimization	PBE	TZP	-5.63759485; Eh
	19-Mar-2026	/Ta Ta01O5-4H-iso-0	Buils, Jordi	ADF; 2019	Geometry optimization	PBE	TZP	-2.46440900; Eh
	2-Jul-2025	/Bulk_structure/pourbaix_diagram/Cu2WO4/phonopy/disp_013 disp_013	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-5036.15978861; eV

Results 90121-90130 of 103542 (Search time: 0.05 seconds).