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Juan Maria García Lastra
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Journal Articles

Thermodynamic investigation of phase transformation in Sn anode for magnesium batteries

Smobin Vincent, David Kleiven, Juan Maria Garcia Lastra, Jin Hyun Chang
Journal: APL Materials
APL Mater. 10, 071104 (2022)
https://doi.org/10.1063/5.0087046
Published: July 2022
View article titled, Thermodynamic investigation of phase transformation in Sn anode for magnesium batteries
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Journal Articles

Element-specific investigations of ultrafast dynamics in photoexcited Cu2ZnSnS4 nanoparticles in solution

Christian Rein, Jens Uhlig, David Carrasco-Busturia, Khadijeh Khalili, Anders S. Gertsen, Asbjørn Moltke, Xiaoyi Zhang, Tetsuo Katayama, Juan Maria García Lastra, Martin Meedom Nielsen, Shin-Ichi Adachi, Kristoffer Haldrup, Jens Wenzel Andreasen
Journal: Structural Dynamics
Struct. Dyn. 8, 024501 (2021)
https://doi.org/10.1063/4.0000055
Published: April 2021
View article titled, Element-specific investigations of ultrafast dynamics in photoexcited Cu<sub>2</sub>ZnSnS<sub>4</sub> nanoparticles in solution
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Includes: Supplementary data
Journal Articles

Prediction of crystalline Ta4O9 phase using first principles-based cluster expansion calculations

Christian Søndergaard Pedersen, Jin Hyun Chang, Yang Li, Nini Pryds, Juan Maria Garcia Lastra
Journal: APL Materials
APL Mater. 8, 121101 (2020)
https://doi.org/10.1063/5.0027018
Published: December 2020
View article titled, Prediction of crystalline Ta<sub>4</sub>O<sub>9</sub> phase using first principles-based cluster expansion calculations
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Includes: Supplementary data
Journal Articles

Phase separation in amorphous tantalum oxide from first principles

Christian Søndergaard Pedersen, Jin Hyun Chang, Yang Li, Nini Pryds, Juan Maria Garcia Lastra
Journal: APL Materials
APL Mater. 8, 071108 (2020)
https://doi.org/10.1063/5.0011390
Published: July 2020
View article titled, Phase separation in amorphous tantalum oxide from first principles
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Includes: Supplementary data
Journal Articles

Tuning the resistive switching in tantalum oxide-based memristors by annealing

Yang Li, Y. Eren Suyolcu, Simone Sanna, Dennis Valbjørn Christensen, Marie Lund Traulsen, Eugen Stamate, Christian Søndergaard Pedersen, Peter A. van Aken, Juan Maria García Lastra, Vincenzo Esposito, Nini Pryds
Journal: AIP Advances
AIP Advances 10, 065112 (2020)
https://doi.org/10.1063/5.0004722
Published: June 2020
View article titled, Tuning the resistive switching in tantalum oxide-based memristors by annealing
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Includes: Supplementary data
Journal Articles

The effect of CO2 contamination in rechargeable non-aqueous sodium–air batteries

Natei Ermias Benti, Yedilfana Setarge Mekonnen, Rune Christensen, Girum Ayalneh Tiruye, Juan Maria Garcia-Lastra, Tejs Vegge
Journal: The Journal of Chemical Physics
J. Chem. Phys. 152, 074711 (2020)
https://doi.org/10.1063/1.5141931
Published: February 2020
View article titled, The effect of CO<sub>2</sub> contamination in rechargeable non-aqueous sodium–air batteries
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Journal Articles

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

William Nunn, Abhinav Prakash, Arghya Bhowmik, Ryan Haislmaier, Jin Yue, Juan Maria Garcia Lastra, Bharat Jalan
Journal: APL Materials
APL Mater. 6, 066107 (2018)
https://doi.org/10.1063/1.5027567
Published: June 2018
View article titled, Frequency- and temperature-dependent dielectric response in hybrid molecular beam epitaxy-grown BaSnO<sub>3</sub> films
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Includes: Supplementary data
Journal Articles

Machine learning-based screening of complex molecules for polymer solar cells

Peter Bjørn Jørgensen, Murat Mesta, Suranjan Shil, Juan Maria García Lastra, Karsten Wedel Jacobsen, Kristian Sommer Thygesen, Mikkel N. Schmidt
Journal: The Journal of Chemical Physics
J. Chem. Phys. 148, 241735 (2018)
https://doi.org/10.1063/1.5023563
Published: June 2018
View article titled, Machine learning-based screening of complex molecules for polymer solar cells
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Journal Articles

Bandgap calculations and trends of organometal halide perovskites

Ivano E. Castelli, Juan María García-Lastra, Kristian S. Thygesen, Karsten W. Jacobsen
Journal: APL Materials
APL Mater. 2, 081514 (2014)
https://doi.org/10.1063/1.4893495
Published: August 2014
View article titled, Bandgap calculations and trends of organometal halide perovskites
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Journal Articles

Unoccupied states in Cu and Zn octaethyl-porphyrin and phthalocyanine

Peter L. Cook, Wanli Yang, Xiaosong Liu, Juan María García-Lastra, Angel Rubio, F. J. Himpsel
Journal: The Journal of Chemical Physics
J. Chem. Phys. 134, 204707 (2011)
https://doi.org/10.1063/1.3592937
Published: May 2011
View article titled, Unoccupied states in Cu and Zn octaethyl-porphyrin and phthalocyanine
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Journal Articles

Orbital-free effective embedding potential at nuclear cusps

Juan Maria Garcia Lastra, Jakub W. Kaminski, Tomasz A. Wesolowski
Journal: The Journal of Chemical Physics
J. Chem. Phys. 129, 074107 (2008)
https://doi.org/10.1063/1.2969814
Published: August 2008
View article titled, Orbital-free effective embedding potential at nuclear cusps
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