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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	3-Nov-2017	Pd-TPP_A1	Fako, Edvin	vasp; 5.4.4; 25Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	-	-	-661.20316322; eV
	3-Nov-2017	Pd-TPP_A2	Fako, Edvin	vasp; 5.4.4; 24Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	-	-	-437.79327583; eV
	3-Nov-2017	Pd-atom_A2	Fako, Edvin	vasp; 5.4.4; 34Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	-	-	-213.08623215; eV
	3-Nov-2017	Pd-atom_A3	Fako, Edvin	vasp; 5.4.4; 33Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	-	-	-213.40054729; eV
	3-Nov-2017	Pd-atom_A1	Fako, Edvin	vasp; 5.4.4; 35Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	-	-	-213.08623215; eV
	3-Nov-2017	Pd-atom_b	Fako, Edvin	vasp; 5.4.4; 36Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	-	-	-77.46819342; eV
	3-Nov-2017	Pd-atom_a	Fako, Edvin	vasp; 5.4.4; 38Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	-	-	-76.90933824; eV
	3-Nov-2017	Pd-atom_TS1	Fako, Edvin	vasp; 5.4.4; 37Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Single point	-	-	-76.70284968; eV
	12-Feb-2019	sa-RhIr-2322	García Muelas, Rodrigo	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-378.12948398; eV
	12-Feb-2019	sa-RhCo-2223	García Muelas, Rodrigo	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-372.26992151; eV

Results 2551-2560 of 103928 (Search time: 0.004 seconds).