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2017
 

Computational Study of Nb-Doped-SnO2/Pt Interfaces: Dopant Segregation, Electronic Transport, and Catalytic Properties

Fu, Qiang ; Halck, Niels Bendtsen ; Hansen, Heine Anton ; García Lastra, Juan Maria ; Vegge, Tejs
in journal: Chemistry of Materials (ISSN: 0897-4756) (DOI: http://dx.doi.org/10.1021/acs.chemmater.6b04879), vol: 29, issue: 4, pages: 1641-1649, 2017

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: http://dx.doi.org/10.1021/acs.chemmater.6b04879

 

Orientation-Dependent Oxygen Evolution on RuO2 without Lattice Exchange

Stoerzinger, Kelsey A. ; Diaz-Morales, Oscar ; Kolb, Manuel ; Rao, Reshma R. ; Frydendal, Rasmus ; Qiao, Liang ; Wang, Xiao Renshaw ; Halck, Niels Bendtsen ; Rossmeisl, Jan ; Hansen, Heine Anton ; Vegge, Tejs ; E. L. Stephens, Ifan ; Koper, Marc T. M. ; Shao-Horn, Yang
in journal: ACS Energy Letters (ISSN: 2380-8195) (DOI: http://dx.doi.org/10.1021/acsenergylett.7b00135), vol: 2, issue: 4, pages: 876-881, 2017

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: http://dx.doi.org/10.1021/acsenergylett.7b00135

 

Intrinsic Conductivity in Magnesium-Oxygen Battery Discharge Products: MgO and MgO2

Smith, Jeffrey G. ; Naruse, Junichi ; Hiramatsu, Hidehiko ; Siegel, Donald Jason
in journal: Chemistry of Materials (ISSN: 0897-4756) (DOI: http://dx.doi.org/10.1021/acs.chemmater.7b00217), vol: 29, issue: 7, pages: 3152-3163, 2017

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: http://dx.doi.org/10.1021/acs.chemmater.7b00217

 

X-Ray microtomography studies on all-solid-state Li-S batteries built around LiBH4 solid electrolyte

Lefevr, Jessica ; Blanchard, Didier
part of: Proceedings of the Danscatt Annual meeting 2017 , 2017,
Presented at:
DANSCATT Annual meeting 2017, 2017, Odense

Type: Conference abstract in proceedings (Peer reviewed)

Status: Published     |    Year: 2017

 

Jahn-Teller and Non-Jahn-Teller Systems Involving CuF64- Units: Role of the Internal Electric Field in Ba2ZnF6:Cu2+ and Other Insulating Systems

Aramburu, J. A. ; Garcia-Fernandez, P. ; García Lastra, Juan Maria ; Moreno, M.
in journal: Journal of Physical Chemistry C (ISSN: 1932-7447) (DOI: http://dx.doi.org/10.1021/acs.jpcc.6b11999), vol: 121, issue: 9, pages: 5215-5224, 2017

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: http://dx.doi.org/10.1021/acs.jpcc.6b11999

 

Bottom-Up Design of a Copper-Ruthenium Nanoparticulate Catalyst for Low-Temperature Ammonia Oxidation

Chakraborty , Debasish ; Damsgaard, Christian Danvad ; Silva, Hugo José Lopes ; Conradsen, Christian Nagstrup ; Olsen, Jakob Lind ; de Carvalho, Hudson W. P. ; Mutz, Benjamin ; Bligaard, Thomas ; Hoffmann, Max J ; Grunwaldt, Jan-Dierk ; Studt, Felix ; Chorkendorff, Ib
in journal: Angewandte Chemie (International Edition) (ISSN: 1433-7851) (DOI: http://dx.doi.org/10.1002/anie.201703468), 2017

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: http://dx.doi.org/10.1002/anie.201703468

  PDF

Error Mitigation in Computational Design of Sustainable Energy Materials

Christensen, Rune ; Vegge, Tejs (Supervisor) ; Hansen, Heine Anton (Supervisor)
Department of Energy Conversion and Storage, Technical University of Denmark, (ISBN: 978-87-92986-58-0), pages: 210

Type: Ph.D. thesis

Status: Published     |    Year: 2017

  PDF

A Physically-Based Equivalent Circuit Model for the Impedance of a LiFePO4/Graphite 26650 Cylindrical Cell

Scipioni, Roberto ; Jørgensen, Peter Stanley ; Graves, Christopher R. ; Hjelm, Johan ; Jensen, Søren Højgaard
in journal: Electrochemical Society. Journal (ISSN: 0013-4651) (DOI: http://dx.doi.org/10.1149/2.1071709jes), vol: 164, issue: 9, pages: A2017-A2030, 2017

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: http://dx.doi.org/10.1149/2.1071709jes

 

Large Differences in the Optical Spectrum Associated with the Same Complex: The Effect of the Anisotropy of the Embedding Lattice

Aramburu, José Antonio ; García-Fernández, Pablo ; García Lastra, Juan Maria ; Moreno, Miguel
in journal: Inorganic Chemistry (ISSN: 0020-1669) (DOI: http://dx.doi.org/10.1021/acs.inorgchem.7b00932), vol: 56, issue: 15, pages: 8944-8953, 2017

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: http://dx.doi.org/10.1021/acs.inorgchem.7b00932

 

Defect Chemistry and Electrical Conductivity of Sm-Doped La1-xSrxCoO3-δ for Solid Oxide Fuel Cells

Björketun, Mårten ; Castelli, Ivano Eligio ; Rossmeisl, Jan ; Olsen, Thomas ; Ukai, Kenji ; Kato, Michiaki ; Dennler, Gilles ; Jacobsen, Karsten Wedel
in journal: The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter (ISSN: 1932-7447) (DOI: http://dx.doi.org/10.1021/acs.jpcc.7b02608), vol: 121, issue: 28, pages: 15017-15027, 2017

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: http://dx.doi.org/10.1021/acs.jpcc.7b02608