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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	1-Mar-2022	0-34	Daelman, Nathan	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 31 2018 20:07:58) gamma-only	Geometry optimization	DFT	-	-857.13005617; eV
	8-Apr-2025	/strained100 100_+5_0strain-3CO	Ibáñez-Alé, Enric	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-
	19-Nov-2025	TS1c-2c	García-Padilla, Eduardo	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RBP86	6-31G SDD LANL2DZ GENECP*	-3899.60905119; Eh
	17-Jul-2025	h_14_cu_ni3p2	Naeem, Muhammad Saad	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-826.12444217; eV
	16-Jan-2026	/FG_dataset/aromatics2/rh/111 rh-9802-a	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-447.02936461; eV
	16-Jan-2026	/FG_dataset/group3N/gas 49Na	Morandi, Santiago	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-77.48977885; eV
	9-Oct-2023	/VO2_M1_relaxed VO2_M1_relaxed_gga-u	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-96.52339895; eV
	9-Oct-2023	/VO2_M1_relaxed VO2_M1_relaxed_phonon	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Frequencies	DFT	-	-94.88904908; eV
	9-Oct-2023	/VO2_M1_relaxed VO2_M1_relaxed_scan	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Single point	DFT	-	-1212.10217950; eV
	1-Aug-2023	VO2-R	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Single point	DFT	-	-51.77596326; eV

Results 88011-88020 of 103542 (Search time: 0.056 seconds).