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Showing results 1 to 7 of 7

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	2-Sep-2022	Figure 4f	Dandu, Naveen; Rojas, Tomas; Ngo, Anh; Hla, Saw-Wai	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jul 07 2017 12:30:28) gamma-only	Geometry optimization	DFT	-	-1423.28981274; eV
	2-Sep-2022	Figure 4g i	Dandu, Naveen; Rojas, Tomas; Ngo, Anh; Hla, Saw-Wai	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jul 07 2017 12:30:28) gamma-only	Geometry optimization	DFT	-	-
	2-Sep-2022	Figure 4g ii (Figure 4h)	Dandu, Naveen; Rojas, Tomas; Ngo, Anh; Hla, Saw-Wai	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jul 07 2017 12:30:28) gamma-only	Geometry optimization	DFT	-	-
	2-Sep-2022	Figure 4g iii	Dandu, Naveen; Rojas, Tomas; Ngo, Anh; Hla, Saw-Wai	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jul 07 2017 12:30:28) gamma-only	Geometry optimization	DFT	-	-
	2-Sep-2022	Figure 4g iv (Figure 4i)	Dandu, Naveen; Rojas, Tomas; Ngo, Anh; Hla, Saw-Wai	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jul 07 2017 12:30:28) gamma-only	Geometry optimization	DFT	-	-
	2-Sep-2022	Figure 4g v	Dandu, Naveen; Rojas, Tomas; Ngo, Anh; Hla, Saw-Wai	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jul 07 2017 12:30:28) gamma-only	Geometry optimization	DFT	-	-
	2-Sep-2022	Figure 4g vi	Dandu, Naveen; Rojas, Tomas; Ngo, Anh; Hla, Saw-Wai	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jul 07 2017 12:30:28) gamma-only	Geometry optimization	DFT	-	-

Showing results 1 to 7 of 7