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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	22-Feb-2018	Pt_3H	Project, POROUSforAPP	vasp; 5.3.5; 31Mar14 (build May 07 2014 16:01:45) complex	Geometry optimization	-	-	-680.62968318; eV
	22-Feb-2018	Pt_4H	Project, POROUSforAPP	vasp; 5.3.5; 31Mar14 (build May 07 2014 16:01:45) complex	Geometry optimization	-	-	-681.88679753; eV
	22-Feb-2018	Pd_1	Project, POROUSforAPP	vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex	Geometry optimization	-	-	-625.82779272; eV
	25-Feb-2021	/Coverage_Analysis/O 5_O	Brennan, Kevin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complex	Geometry optimization	DFT	-	-79.58039139; eV
	25-Feb-2021	/Mechanisms/Electrolyte_Path/2_H N	Brennan, Kevin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complex	Geometry optimization	DFT	-	-177.45096507; eV
	25-Feb-2021	/Mechanisms/Electrolyte_Path/3_H C	Brennan, Kevin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complex	Geometry optimization	DFT	-	-182.26781476; eV
	25-Feb-2021	/Mechanisms/Chemical_Path/3_H CH2NH2	Brennan, Kevin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complex	Geometry optimization	DFT	-	-182.30510082; eV
	25-Feb-2021	/Mechanisms/Chemical_Path/4_H CH3NH	Brennan, Kevin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complex	Geometry optimization	DFT	-	-181.21563746; eV
	25-Feb-2021	/Mechanisms/Chemical_Path/4_H CH3NH_regen	Brennan, Kevin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complex	Geometry optimization	DFT	-	-185.25287348; eV
	25-Feb-2021	/Mechanisms/Chemical_Path/4_H CH2NH2	Brennan, Kevin	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complex	Geometry optimization	DFT	-	-182.30879633; eV

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