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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	2-Oct-2023	/CoVO VCO_bulk	Benzidi, Hind	vasp; 5.3.3; 18Dez12 (build Mar 13 2019 16:05:56) complex	Geometry optimization	DFT	-	-142.50381223; eV
	1-Jul-2023	pristine-4xN6-pristine-4xN6-4.43_03	Ruiz, Andrea	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-1947.53586790; eV
	1-Jul-2023	pristine-4xN6-pristine-4xN6-4.43_04	Ruiz, Andrea	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-1947.52993981; eV
	2-Oct-2023	/CWO_delamination CWO_H2O_2-OH2_M1	Benzidi, Hind	vasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complex	N/A	DFT	-	-741.03843823; eV
	2-Oct-2023	/CWO_del_config CWO_H2O_6	Benzidi, Hind	vasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complex	N/A	DFT	-	-791.31345342; eV
	2-Oct-2023	/Non-Periodic_Systems H2O_pbe_solv	Benzidi, Hind	vasp; 5.3.3; 18Dez12 (build Mar 13 2019 16:05:56) complex	Single point	DFT	-	-13.80108749; eV
	2-Oct-2023	/CWO_surface CWO_solvation	Benzidi, Hind	vasp; 5.3.3; 18Dez12 (build Mar 13 2019 16:05:56) complex	Single point	DFT	-	-783.19077255; eV
	2-Oct-2023	/CWO_surface CWO_solv	Benzidi, Hind	vasp; 5.3.3; 18Dez12 (build Mar 13 2019 16:05:56) complex	Single point	DFT	-	-747.16758142; eV
	2-Oct-2023	/CWO_surface CWO_Co_diss	Benzidi, Hind	vasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complex	N/A	DFT	-	-741.93772154; eV
	2-Oct-2023	/CWO_surface CWO_surf	Benzidi, Hind	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-

Results 28911-28920 of 103542 (Search time: 0.018 seconds).