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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-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_y	Fako, Edvin	vasp; 5.4.4; 32Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	-	-	-147.11606109; eV
	3-Nov-2017	Pd-TPP_b	Fako, Edvin	vasp; 5.4.4; 26Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	-	-	-525.89610358; 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-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-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_A2	Fako, Edvin	vasp; 5.4.4; 34Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-only	Geometry optimization	-	-	-213.08623215; eV
	29-Feb-2016	TS3b-trans-trans-solv	González Fabra, Joan	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB97D3	6-311G**	-3793.38967449; Eh
	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

Results 19141-19150 of 104510 (Search time: 0.086 seconds).