Juan Maria García Lastra

Juan Maria García Lastra

Associate Professor

Department of Energy Conversion and Storage

Technical University of Denmark


Building 309, room 157

2800 Kgs. Lyngby

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Role of Long-Range Dispersion Forces in Modeling of MXenes as Battery Electrode Materials

Tygesen, Alexander S. ; Pandey, Mohnish ; Vegge, Tejs ; Thygesen, Kristian Sommer ; García-Lastra, Juan M.
in: The Journal of Physical Chemistry Part C, vol: 123, issue: 7, pages: 4064-4071

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2019     |    DOI: https://doi.org/10.1021/acs.jpcc.8b11663


Surface Pyroelectricity in Cubic SrTiO3

Meirzadeh, Elena ; Christensen, Dennis Valbjørn ; Makagon, Evgeniy ; Cohen, Hagai ; Rosenhek-Goldian, Irit ; Morales, Erie H ; Bhowmik, Arghya ; Lastra, Juan Maria G ; Rappe, Andrew M ; Ehre, David ; Lahav, Meir ; Pryds, Nini ; Lubomirsky, Igor
in: Advanced Materials

Type: Journal article (Peer reviewed)

Status: Accepted/In press     |    Year: 2019     |    DOI: https://doi.org/10.1002/adma.201904733


Tuning the stoichiometry and electrical properties of tantalum oxide thin films

Li, Yang ; Sanna, Simone ; Norrman, Kion ; Christensen, Dennis Valbjørn ; Pedersen, Christian Søndergaard ; García Lastra, Juan Maria ; Traulsen, Marie Lund ; Esposito, Vincenzo ; Pryds, Nini
in: Applied Surface Science, vol: 470, pages: 1071-1074

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2019     |    DOI: https://doi.org/10.1016/j.apsusc.2018.11.153


Adiabatic and Nonadiabatic Charge Transport in Li-S Batteries

Park, Haesun ; Kumar, Nitin ; Melander, Marko ; Vegge, Tejs ; García Lastra, Juan Maria ; Siegel, Donald Jason
in: Chemistry of Materials, vol: 30, issue: 3, pages: 915-928

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1021/acs.chemmater.7b04618


Changing the Usual Interpretation of the Structure and Ground State of Cu2+-Layered Perovskites

Aramburu, J. A. ; García-Fernández, P. ; Mathiesen, N. R. ; García-Lastra, J. M. ; Moreno, M.
in: Journal of Physical Chemistry C, vol: 122, issue: 9, pages: 5071-5082

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1021/acs.jpcc.8b00608


Combined DFT and DEMS investigation of the effect of dopants in secondary zinc‐air batteries

Lysgaard, Steen ; Christensen, Mathias K. ; Hansen, Heine A. ; García Lastra, Juan Maria ; Norby, Poul ; Vegge, Tejs
in: ChemSusChem (Print), vol: 11, issue: 12, pages: 1933-1941

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1002/cssc.201800225


Comparative DFT+U and HSE Study of the Oxygen Evolution Electrocatalysis on Perovskite Oxides

Tripkovic, Vladimir ; Hansen, Heine Anton ; García Lastra, Juan Maria ; Vegge, Tejs
in: The Journal of Physical Chemistry Part C, vol: 122, issue: 2, pages: 1135-1147

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1021/acs.jpcc.7b07660


Correction to Implementation of Constrained DFT for Computing Charge Transfer Rates within the Projector Augmented Wave Method

Melander, Marko ; Jónsson, Elvar Örn ; Mortensen, Jens Jørgen ; Vegge, Tejs ; García Lastra, Juan Maria
in: Journal of Chemical Theory and Computation, vol: 14, issue: 2, pages: 1170

Type: Comment/debate (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1021/acs.jctc.8b00053


Does the breaking of adsorption-energy scaling relations guarantee enhanced electrocatalysis?

Govindarajan, Nitish ; García-Lastra, Juan M. ; Meijer, Evert Jan ; Calle-Vallejo, Federico
in: Current Opinion in Electrochemistry, vol: 8, pages: 110-117

Type: Review (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1016/j.coelec.2018.03.025


Frequency- and temperature-dependent dielectric response in hybrid molecular beam epitaxy-grown BaSnO3 films

Nunn, William ; Prakash, Abhinav ; Bhowmik, Arghya ; Haislmaier, Ryan ; Yue, Jin ; García Lastra, Juan Maria ; Jalan, Bharat
in: A P L Materials, vol: 6, issue: 6

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1063/1.5027567